data_2hv1_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 2hv1 _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 ' 8' ' ' GLN . . . . . 0.55 ' HA ' HG11 ' B' ' 71' ' ' VAL . 16.5 mt-30 . . . . . 0 C--O 1.235 0.306 0 CA-C-O 120.647 0.26 . . . . 15.44 110.728 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -72.87 159.8 47.44 Favored 'Trans proline' 0 C--O 1.234 0.292 0 C-N-CA 122.859 2.373 . . . . 14.109999999999999 112.013 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' THR . . . . . 0.481 HG21 HG22 ' A' ' 32' ' ' THR . 0.1 OUTLIER -83.14 52.04 2.1 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.333 0.587 . . . . 11.369999999999999 111.106 179.92 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.66 ' HB2' HG22 ' A' ' 111' ' ' THR . 37.6 tt0 -147.09 136.93 23.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.446 -0.797 . . . . 10.59 108.964 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.828 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 42.5 p90 -151.75 154.16 35.72 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.071 0.463 . . . . 9.1999999999999993 111.489 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.1 mm -88.64 127.31 41.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.061 -0.518 . . . . 8.9399999999999995 110.842 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.891 ' HB3' ' HE2' ' A' ' 22' ' ' PHE . 1.4 m -110.23 97.39 6.88 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.831 -0.622 . . . . 6.1100000000000003 110.791 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 11.2 mtt180 -86.24 110.43 19.61 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.545 -0.539 . . . . 9.4600000000000009 109.545 179.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 33.3 p80 -147.03 156.2 42.83 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.629 -0.259 . . . . 10.369999999999999 110.558 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -76.62 -175.68 3.46 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.628 0.252 . . . . 13.279999999999999 110.926 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 26.9 pt -62.31 -25.44 37.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 N-CA-C 112.873 0.694 . . . . 13.970000000000001 112.873 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -76.5 -30.53 57.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.214 0.53 . . . . 13.85 110.669 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 118.02 -6.38 15.4 Favored Glycine 0 N--CA 1.444 -0.814 0 N-CA-C 111.225 -0.75 . . . . 9.6099999999999994 111.225 -179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.44 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 34.6 mm -68.69 117.84 11.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 O-C-N 123.973 0.455 . . . . 11.289999999999999 109.791 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.891 ' HE2' ' HB3' ' A' ' 14' ' ' SER . 87.7 m-85 -73.2 132.92 43.78 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.083 0.468 . . . . 10.449999999999999 112.081 -178.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.02 -27.37 12.17 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.3 -0.864 . . . . 8.1300000000000008 110.278 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.417 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 31.2 t80 -154.33 121.63 5.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.701 -0.681 . . . . 7.4900000000000002 109.516 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.61 ' HB ' ' HB3' ' A' ' 37' ' ' PRO . 4.8 t -110.39 146.36 15.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.033 0.444 . . . . 6.4500000000000002 111.236 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.828 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 6.0 t70 -68.5 170.89 8.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.546 -0.752 . . . . 7.3099999999999996 110.459 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -94.27 -21.43 19.02 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.11 0.481 . . . . 12.41 110.077 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 77.0 mtm180 -78.92 0.1 28.73 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.866 -0.606 . . . . 12.19 111.89 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 28.2 p -64.96 -33.51 76.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.972 0.415 . . . . 13.5 110.641 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.5 ' O ' ' HA2' ' A' ' 34' ' ' GLY . 2.9 t -69.59 -27.08 32.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.933 -0.576 . . . . 16.559999999999999 110.726 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.92 -24.38 26.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.105 0.479 . . . . 15.07 110.278 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.481 HG22 HG21 ' A' ' 10' ' ' THR . 25.2 m -85.01 -61.92 1.66 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.753 -0.658 . . . . 15.26 111.699 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.539 HG22 ' H ' ' A' ' 35' ' ' TYR . 15.6 m -111.35 -15.22 10.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 111.941 0.349 . . . . 14.18 111.941 -179.245 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.5 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 89.39 0.11 80.19 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.423 -0.894 . . . . 13.85 112.325 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.539 ' H ' HG22 ' A' ' 33' ' ' VAL . 0.7 OUTLIER -83.46 135.04 34.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.653 0.263 . . . . 18.59 110.458 179.882 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.656 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 79.0 mm-40 -75.41 146.71 81.49 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 116.054 -0.521 . . . . 15.890000000000001 110.059 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.61 ' HB3' ' HB ' ' A' ' 25' ' ' VAL . 41.6 Cg_exo -57.12 -35.35 98.89 Favored 'Trans proline' 0 CA--C 1.527 0.166 0 C-N-CA 122.588 2.192 . . . . 12.26 112.185 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.442 ' HA ' HD12 ' A' ' 41' ' ' LEU . 22.4 mp0 -69.25 -15.93 63.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.96 -0.564 . . . . 13.68 111.493 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.656 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 34.8 mt-10 -81.09 -32.48 33.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.786 0.327 . . . . 17.34 111.013 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.573 ' HB2' HG21 ' A' ' 25' ' ' VAL . 2.9 mm? -82.1 -24.66 35.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.121 -0.49 . . . . 13.56 110.915 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 89.7 mt -62.69 116.69 5.42 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.136 -0.484 . . . . 13.42 111.402 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.32 -4.26 85.34 Favored Glycine 0 N--CA 1.451 -0.339 0 CA-C-N 115.879 -0.601 . . . . 13.390000000000001 112.694 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.459 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 6.1 mmpt? -107.87 161.91 14.49 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.617 0.246 . . . . 17.239999999999998 110.457 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.747 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 15.1 m120 -95.66 139.02 32.51 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.544 -0.539 . . . . 12.77 109.544 179.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.569 HG13 ' HE1' ' A' ' 78' ' ' PHE . 9.1 tt -61.85 -30.37 48.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.016 0.436 . . . . 12.050000000000001 110.589 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.0 p -65.7 -22.03 30.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 116.183 -0.462 . . . . 13.390000000000001 111.254 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.747 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 41.1 mt-10 -73.83 -17.73 61.03 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.358 -0.383 . . . . 16.530000000000001 111.553 -179.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -117.97 24.53 10.96 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.17 0.51 . . . . 15.83 110.198 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 48.9 t -112.08 155.73 23.38 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.665 -0.698 . . . . 12.01 110.305 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.578 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 4.9 t-160 -56.92 122.33 51.93 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.842 -0.617 . . . . 15.130000000000001 109.408 178.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 99.2 Cg_exo -45.29 -49.06 10.7 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.456 2.77 . . . . 15.83 114.157 -178.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -75.77 0.93 16.22 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.291 0.478 . . . . 16.690000000000001 112.291 -179.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.578 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 26.4 m-20 -124.96 7.78 8.03 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.162 0.506 . . . . 13.16 110.159 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -66.35 -44.1 84.17 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.79 -0.641 . . . . 16.170000000000002 110.592 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.7 tp60 -62.58 -38.36 89.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.302 -0.408 . . . . 14.35 109.925 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.9 tp -57.48 -40.12 77.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.89 -0.595 . . . . 12.51 110.182 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.411 HD21 ' HA ' ' A' ' 57' ' ' LEU . 0.9 OUTLIER -69.59 -49.03 58.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.793 -0.639 . . . . 10.08 110.155 179.348 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.417 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 70.6 ttt180 -58.61 -48.61 80.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.986 -0.552 . . . . 11.710000000000001 111.392 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -56.56 -44.98 81.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.039 0.447 . . . . 9.7100000000000009 110.807 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.3 m -70.28 -31.36 68.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.017 -0.538 . . . . 9.5199999999999996 110.994 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.53 ' O ' HG23 ' A' ' 65' ' ' VAL . 1.4 m-30 -65.12 -49.99 67.79 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.048 -0.353 . . . . 12.109999999999999 110.048 178.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.417 ' HG2' ' O ' ' A' ' 58' ' ' ARG . 12.7 mm100 -64.8 -29.9 70.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.337 0.589 . . . . 10.289999999999999 109.572 179.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -66.27 -48.56 70.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.014 -0.993 . . . . 10.619999999999999 110.648 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.522 HG12 ' O ' ' A' ' 61' ' ' PHE . 4.3 p -64.74 -25.1 37.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-O 120.838 0.351 . . . . 10.93 110.87 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.59 ' HA ' HG21 ' A' ' 94' ' ' THR . 93.1 t -70.61 -40.39 77.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 108.954 -0.758 . . . . 12.890000000000001 108.954 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -72.97 -29.24 62.91 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.546 -0.752 . . . . 16.68 109.963 178.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.707 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 88.7 mt -70.13 -48.17 58.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.981 -0.554 . . . . 13.18 109.94 178.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 32.8 mttt 59.61 99.47 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.571 -0.741 . . . . 15.17 112.607 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.03 -26.27 13.75 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.674 -0.774 . . . . 10.01 112.886 178.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.707 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 7.9 tp-100 -79.11 113.12 16.98 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.744 0.307 . . . . 10.039999999999999 110.251 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 3.0 p -66.64 116.6 6.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.804 -0.634 . . . . 8.5399999999999991 110.805 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 64.8 tp -111.88 108.15 17.42 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.696 -0.684 . . . . 8.1300000000000008 110.381 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.566 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 1.2 m -87.45 109.33 19.51 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.961 -0.563 . . . . 7.8899999999999997 110.95 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.8 p -102.34 132.93 47.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.766 -0.457 . . . . 8.1799999999999997 109.766 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' MET . . . . . 0.471 ' HG2' ' HE3' ' A' ' 87' ' ' TRP . 23.1 ttt -102.41 122.0 43.44 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.904 0.383 . . . . 9.6999999999999993 111.07 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.518 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 47.8 p90 -148.89 -174.7 4.7 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.204 -0.453 . . . . 10.27 110.075 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.477 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 31.2 mtm180 -110.61 120.65 43.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.12 0.486 . . . . 13.859999999999999 110.297 178.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.569 ' HE1' HG13 ' A' ' 45' ' ' ILE . 15.9 t80 -101.0 153.51 19.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.311 -0.859 . . . . 9.7300000000000004 110.143 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.519 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 42.7 ttt180 -90.01 124.0 34.38 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.13 -0.486 . . . . 11.300000000000001 110.636 179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.424 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 59.5 p -85.84 -179.43 6.82 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.22 -0.446 . . . . 11.039999999999999 110.469 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -71.16 -14.45 62.28 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.516 0.674 . . . . 13.18 109.476 179.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.451 ' O ' ' HB2' ' A' ' 83' ' ' GLN . 87.9 m-20 -88.77 -1.79 58.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.435 -0.802 . . . . 14.890000000000001 109.74 179.031 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.451 ' HB2' ' O ' ' A' ' 82' ' ' ASN . 2.9 mp0 72.54 22.62 3.28 Favored 'General case' 0 N--CA 1.465 0.277 0 O-C-N 123.902 0.751 . . . . 12.92 110.748 -179.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.47 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.0 pt-20 -97.68 170.41 9.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.823 -0.626 . . . . 10.94 109.515 179.264 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.519 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 51.5 m95 -116.72 110.75 18.85 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.86 0.362 . . . . 11.77 110.529 -179.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 77' ' ' ARG . 0.5 OUTLIER -108.74 150.17 27.98 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.09 -0.504 . . . . 11.57 110.581 -179.821 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.889 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 72.0 m95 -82.35 117.12 22.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.972 0.415 . . . . 10.73 110.394 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.41 ' SD ' ' HB3' ' A' ' 110' ' ' ASN . 9.2 ttp -126.04 138.59 53.73 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.055 -0.52 . . . . 9.7400000000000002 110.602 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 89' ' ' ARG . 33.1 ttp-105 -103.81 107.38 18.23 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.896 -0.779 . . . . 11.16 108.896 178.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.611 HG22 ' HB3' ' A' ' 108' ' ' CYS . 24.7 m -92.61 105.37 17.54 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.742 -0.663 . . . . 9.5899999999999999 112.426 -178.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.767 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 64.0 m -82.28 87.21 6.57 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.525 -0.917 . . . . 8.8800000000000008 108.525 177.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.485 ' HA ' ' HA ' ' A' ' 108' ' ' CYS . 32.8 m -74.98 125.23 28.46 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.059 -0.519 . . . . 8.9399999999999995 111.739 -178.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -123.41 109.52 13.97 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.593 -0.73 . . . . 12.1 109.58 179.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.59 HG21 ' HA ' ' A' ' 65' ' ' VAL . 0.2 OUTLIER -72.11 123.41 22.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.424 -0.353 . . . . 10.16 110.483 179.922 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . 0.441 ' O ' ' HA ' ' A' ' 103' ' ' ILE . 23.0 t80 -92.48 113.21 25.43 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.929 0.395 . . . . 12.6 111.09 -179.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -92.62 132.21 37.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.855 -0.611 . . . . 14.6 110.487 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -85.29 138.62 36.4 Favored Pre-proline 0 C--N 1.319 -0.751 0 N-CA-C 109.752 -0.462 . . . . 13.83 109.752 178.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -64.2 -11.45 27.84 Favored 'Trans proline' 0 CA--C 1.531 0.362 0 C-N-CA 122.753 2.302 . . . . 15.34 114.053 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -62.98 -74.7 0.09 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.741 0.305 . . . . 16.890000000000001 110.998 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.3 m -127.08 24.52 6.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.579 -0.282 . . . . 15.140000000000001 110.966 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 28.7 t70 62.64 35.52 14.19 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.445 0.641 . . . . 14.94 110.615 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.1 139.47 30.94 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.406 -0.361 . . . . 12.949999999999999 110.382 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.441 ' HA ' ' O ' ' A' ' 95' ' ' PHE . 50.5 mt -83.32 106.97 14.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.209 -0.45 . . . . 11.44 109.967 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -73.2 -38.96 65.93 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.882 -0.327 . . . . 11.65 110.661 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.457 ' HE1' HG12 ' A' ' 107' ' ' ILE . 16.3 p90 -159.8 167.98 26.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.378 -0.374 . . . . 10.35 110.291 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 21.4 mt -110.18 120.63 61.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.969 -0.56 . . . . 10.470000000000001 110.138 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.614 HG23 HH22 ' B' ' 15' ' ' ARG . 15.7 mt -88.54 95.92 5.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.098 -0.501 . . . . 9.3200000000000003 109.657 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.611 ' HB3' HG22 ' A' ' 90' ' ' THR . 96.3 m -91.07 116.32 28.7 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.086 -0.507 . . . . 10.15 111.936 -178.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.767 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 2.8 m -86.97 97.55 10.76 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.798 -0.815 . . . . 11.4 108.798 178.286 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.435 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 8.5 m-20 -86.14 104.82 16.07 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.143 -0.481 . . . . 11.640000000000001 111.908 -177.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.66 HG22 ' HB2' ' A' ' 11' ' ' GLU . 1.9 m -112.15 120.05 40.48 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.751 -0.462 . . . . 11.220000000000001 109.751 178.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . 0.47 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 2.6 t-20 -72.13 129.57 38.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.182 0.515 . . . . 12.98 111.072 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 3.5 t -103.45 -46.36 10.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.543 -0.753 . . . . 15.109999999999999 110.058 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.889 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 51.8 mtpt . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.44 -0.79 . . . . 16.32 109.74 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 56.1 m . . . . . 0 N--CA 1.479 1.02 0 CA-C-O 120.989 0.423 . . . . 7.8399999999999999 110.373 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' GLN . . . . . 0.812 ' HG3' ' HA ' ' B' ' 28' ' ' ARG . 1.7 pm0 -108.15 150.6 40.67 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.234 -0.439 . . . . 7.4900000000000002 109.887 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' B' ' 8' ' ' GLN . 11.3 Cg_exo -72.32 176.23 8.9 Favored 'Trans proline' 0 C--O 1.234 0.287 0 C-N-CA 122.842 2.361 . . . . 6.4400000000000004 112.23 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' THR . . . . . 0.785 HG21 ' HA ' ' B' ' 32' ' ' THR . 0.1 OUTLIER -82.59 50.5 1.67 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.272 -0.422 . . . . 5.9800000000000004 111.684 -179.718 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.584 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -148.28 139.71 23.53 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.608 -0.515 . . . . 5.8499999999999996 109.608 179.709 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' PHE . . . . . 0.692 ' HB3' ' HB2' ' B' ' 28' ' ' ARG . 33.8 p90 -155.28 153.37 30.49 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.018 0.437 . . . . 6.4900000000000002 111.245 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . 0.568 HG13 HG21 ' B' ' 107' ' ' ILE . 9.1 tt -88.03 113.26 24.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.651 -0.704 . . . . 6.0199999999999996 110.47 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.422 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.7 OUTLIER -98.1 91.66 5.39 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.963 -0.562 . . . . 5.3700000000000001 110.633 179.641 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . 0.614 HH22 HG23 ' A' ' 107' ' ' ILE . 8.7 mtp180 -82.56 111.22 18.35 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.884 -0.784 . . . . 9.4600000000000009 108.884 179.281 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . 0.765 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 0.6 OUTLIER -146.51 172.5 13.46 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.367 -0.379 . . . . 8.3100000000000005 111.425 -178.55 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -82.01 175.53 10.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.204 -0.453 . . . . 11.19 110.98 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 18.2 pt -58.82 -28.49 37.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 N-CA-C 113.039 0.755 . . . . 9.3699999999999992 113.039 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -79.22 -10.37 59.8 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.882 0.372 . . . . 11.92 111.51 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 101.86 -8.35 55.99 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.452 -0.88 . . . . 8.6799999999999997 112.987 179.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . 0.489 ' O ' ' HB2' ' B' ' 16' ' ' HIS . 24.8 mm -63.86 111.97 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 110.235 -0.283 . . . . 11.16 110.235 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . 0.765 ' HA ' ' HB3' ' B' ' 16' ' ' HIS . 97.4 m-85 -63.75 125.13 23.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.125 -0.489 . . . . 8.5999999999999996 111.705 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 3.1 m -98.87 -44.47 6.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.537 -0.756 . . . . 7.9100000000000001 110.605 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . 0.604 ' HD2' ' HD3' ' B' ' 15' ' ' ARG . 78.5 t80 -147.35 123.0 10.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.878 -0.601 . . . . 8.5 109.983 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 25.7 t -120.72 131.58 72.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.177 -0.465 . . . . 6.5 110.361 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -69.77 158.94 34.49 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.748 -0.464 . . . . 7.1500000000000004 109.748 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -78.2 51.03 0.96 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.29 -0.414 . . . . 9.4100000000000001 111.717 -178.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . 0.812 ' HA ' ' HG3' ' B' ' 8' ' ' GLN . 23.5 mtm180 -125.37 -16.98 5.74 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.816 0.341 . . . . 9.7599999999999998 110.583 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 22.7 p -61.71 -27.01 68.41 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.167 -0.469 . . . . 11.56 111.656 -179.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . 0.426 HG12 HE22 ' B' ' 36' ' ' GLN . 34.0 t -59.75 -39.52 79.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.052 -0.522 . . . . 14.01 111.19 -179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.9 -15.4 39.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.332 -0.395 . . . . 12.9 111.285 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' THR . . . . . 0.785 ' HA ' HG21 ' B' ' 10' ' ' THR . 4.1 m -88.59 -53.27 4.73 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.254 0.464 . . . . 12.34 112.254 -178.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' VAL . . . . . 0.628 HG13 ' HD2' ' B' ' 78' ' ' PHE . 3.5 m -124.93 -13.07 5.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 112.455 0.539 . . . . 13.869999999999999 112.455 -178.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.1 -21.0 36.56 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.4 -0.905 . . . . 14.369999999999999 112.06 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -67.08 128.88 38.02 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.92 -0.4 . . . . 15.56 109.92 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . 0.557 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 27.5 mm-40 -74.99 149.79 85.46 Favored Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 109.62 -0.511 . . . . 13.859999999999999 109.62 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.587 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 61.9 Cg_exo -51.4 -42.27 55.72 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.748 2.298 . . . . 15.210000000000001 112.503 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 -62.17 -27.92 69.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.907 -0.588 . . . . 17.82 111.577 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.557 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 30.6 mt-10 -72.84 -33.22 66.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.385 -0.371 . . . . 14.42 110.449 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.404 ' HB3' ' CG ' ' B' ' 22' ' ' PHE . 1.1 mm? -80.83 -30.89 35.69 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.104 -0.498 . . . . 14.550000000000001 111.106 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 79.6 mt -60.03 119.19 7.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 14.050000000000001 110.937 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.05 5.61 73.03 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.976 -0.63 . . . . 11.68 112.448 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.483 ' O ' ' HA ' ' B' ' 21' ' ' ILE . 1.7 mmpt? -116.64 154.29 30.79 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.63 0.252 . . . . 14.17 110.747 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' ASN . . . . . 0.92 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 15.3 m120 -89.47 135.4 33.62 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.542 -0.54 . . . . 10.74 109.542 179.331 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . 0.417 HG21 ' HZ ' ' B' ' 61' ' ' PHE . 19.0 tt -61.96 -26.39 39.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.156 0.503 . . . . 9.8800000000000008 110.634 179.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' VAL . . . . . 0.523 HG12 ' HB3' ' B' ' 44' ' ' ASN . 14.4 p -71.24 -22.1 22.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 CA-C-N 115.815 -0.629 . . . . 11.779999999999999 111.353 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . 0.92 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 35.9 mt-10 -69.69 -35.86 75.47 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.087 0.47 . . . . 11.890000000000001 110.652 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -97.11 8.78 43.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.883 -0.599 . . . . 14.279999999999999 109.915 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 44.4 t -93.27 147.79 22.6 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.861 -0.609 . . . . 10.81 110.858 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 5.4 t-160 -58.7 128.75 84.26 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.47 -0.787 . . . . 12.029999999999999 109.595 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -46.91 -51.09 9.77 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.186 2.591 . . . . 11.869999999999999 113.412 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -68.35 -5.26 17.84 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.311 0.486 . . . . 9.2799999999999994 112.311 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -120.8 5.5 10.48 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.692 0.282 . . . . 7.5199999999999996 111.185 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -64.07 -52.43 59.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.443 -0.344 . . . . 6.5700000000000003 111.312 -179.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . 0.528 ' OE1' ' HD3' ' B' ' 58' ' ' ARG . 51.9 tp60 -63.95 -30.8 71.85 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.849 -0.426 . . . . 6.9900000000000002 109.849 179.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.7 tp -59.17 -50.55 73.59 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.213 -0.662 . . . . 5.1399999999999997 109.213 178.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . 0.429 ' HA ' HD22 ' B' ' 57' ' ' LEU . 0.3 OUTLIER -67.56 -41.42 84.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.765 -0.652 . . . . 6.8200000000000003 109.88 178.837 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . 0.528 ' HD3' ' OE1' ' B' ' 55' ' ' GLN . 38.5 ttt180 -55.21 -53.46 55.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.484 -0.78 . . . . 8.6899999999999995 111.358 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . 0.45 ' O ' ' HG3' ' B' ' 63' ' ' GLN . 22.3 t70 -62.71 -37.81 87.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.468 -0.333 . . . . 6.46 110.453 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 50.9 m -61.67 -35.56 78.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 5.5899999999999999 110.58 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 61' ' ' PHE . . . . . 0.534 ' O ' HG12 ' B' ' 64' ' ' VAL . 8.1 m-85 -63.59 -43.31 97.34 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 121.042 0.449 . . . . 8.3300000000000001 109.901 178.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -68.47 -34.95 76.83 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.475 -0.565 . . . . 7.1500000000000004 109.475 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.45 ' HG3' ' O ' ' B' ' 59' ' ' ASP . 52.9 mt-30 -61.67 -47.53 84.94 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.702 -0.681 . . . . 9.5299999999999994 110.968 179.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.534 HG12 ' O ' ' B' ' 61' ' ' PHE . 4.0 p -65.45 -29.82 48.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.402 -0.363 . . . . 8.2200000000000006 111.216 -179.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . 0.514 HG23 ' O ' ' B' ' 61' ' ' PHE . 72.7 t -69.54 -37.51 74.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 109.455 -0.572 . . . . 7.4299999999999997 109.455 178.649 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -72.0 -27.28 62.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.663 -0.699 . . . . 10.52 110.081 178.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.454 ' HB3' ' HB2' ' B' ' 70' ' ' GLN . 52.2 mt -73.08 -61.69 1.73 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.646 -0.706 . . . . 7.5300000000000002 110.531 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 37.0 mttt 65.52 108.99 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.298 0 O-C-N 123.876 0.735 . . . . 8.0099999999999998 111.471 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 79.4 14.16 81.8 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.811 -0.709 . . . . 5.8700000000000001 112.297 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . 0.454 ' HB2' ' HB3' ' B' ' 67' ' ' LEU . 1.3 mp0 -125.19 157.37 36.65 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.237 -0.653 . . . . 5.6299999999999999 109.237 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 71' ' ' VAL . . . . . 0.55 HG11 ' HA ' ' A' ' 8' ' ' GLN . 13.4 p -107.75 136.51 42.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.377 0.608 . . . . 6.0599999999999996 111.121 -179.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 11.5 tp -123.25 111.44 16.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.696 -0.684 . . . . 4.9299999999999997 109.938 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 73' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 0.3 OUTLIER -89.13 117.02 27.82 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.125 -0.489 . . . . 6.79 111.038 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 7.6 p -116.18 135.87 54.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.753 -0.462 . . . . 4.4199999999999999 109.753 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 22.8 ttt -106.91 110.57 22.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.21 0.528 . . . . 5.6699999999999999 111.142 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.412 ' HE2' ' HD1' ' B' ' 78' ' ' PHE . 45.1 p90 -137.07 -178.98 5.44 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.661 -0.7 . . . . 3.75 109.245 179.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 77' ' ' ARG . . . . . 0.555 ' HD2' ' HB3' ' B' ' 85' ' ' TRP . 37.9 mtm180 -106.5 122.2 45.81 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.08 0.467 . . . . 7.3499999999999996 110.626 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . 0.628 ' HD2' HG13 ' B' ' 33' ' ' VAL . 15.6 t80 -103.81 150.58 23.98 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.64 -0.709 . . . . 5.79 109.889 -179.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 79' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' B' ' 79' ' ' ARG . 30.1 ttp180 -89.62 134.22 34.24 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.383 -0.371 . . . . 11.529999999999999 110.468 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 82.0 p -93.29 -176.38 4.12 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.217 -0.447 . . . . 7.4699999999999998 110.087 179.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -70.73 -14.93 62.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.428 0.632 . . . . 12.67 109.391 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 68.5 m-20 -92.11 1.08 57.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.373 -0.83 . . . . 9.25 109.489 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 83' ' ' GLN . . . . . 0.404 ' HA ' ' HG2' ' B' ' 79' ' ' ARG . 2.3 mp0 67.03 22.79 9.9 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.167 -0.924 . . . . 8.75 111.241 -179.463 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -94.31 157.2 16.15 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.465 -0.569 . . . . 6.8700000000000001 109.465 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . 0.555 ' HB3' ' HD2' ' B' ' 77' ' ' ARG . 81.6 m95 -99.38 116.45 31.57 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.832 0.348 . . . . 8.3800000000000008 110.835 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 pp -119.32 145.83 45.81 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.174 -0.467 . . . . 7.25 110.027 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 87' ' ' TRP . . . . . 0.439 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 94.7 m95 -76.39 120.62 21.89 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.098 0.475 . . . . 9.3000000000000007 110.777 -179.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 30.7 tpp -119.62 128.99 54.37 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.49 -0.777 . . . . 4.46 111.166 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 20.4 ttp180 -99.2 82.54 2.72 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.714 -0.847 . . . . 7.3099999999999996 108.714 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 90' ' ' THR . . . . . 0.492 HG22 ' HB3' ' B' ' 108' ' ' CYS . 47.8 m -75.66 114.87 14.74 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.534 -0.757 . . . . 6.1799999999999997 111.712 -178.711 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 91' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' B' ' 73' ' ' SER . 1.4 m -96.73 95.93 8.25 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.565 -0.743 . . . . 6.4500000000000002 109.119 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 10.3 m -84.07 123.4 30.0 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.185 -0.461 . . . . 6.75 112.028 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . 0.45 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 65.0 t80 -120.48 122.58 40.97 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.92 -0.582 . . . . 6.4500000000000002 109.555 179.123 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.79 113.89 21.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.708 0.29 . . . . 9.8800000000000008 111.368 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 95' ' ' PHE . . . . . 0.477 ' HD1' ' HA ' ' B' ' 95' ' ' PHE . 0.0 OUTLIER -82.68 122.6 28.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 8.9100000000000001 110.188 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -98.45 119.35 36.99 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.705 -0.679 . . . . 10.99 111.041 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 97' ' ' ASN . . . . . 0.419 ' C ' ' H ' ' B' ' 99' ' ' TYR . 67.0 t30 -71.27 123.76 89.89 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 108.78 -0.822 . . . . 8.5099999999999998 108.78 178.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.68 21.67 0.17 Allowed 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.023 2.482 . . . . 9.1600000000000001 114.151 -178.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . 0.419 ' H ' ' C ' ' B' ' 97' ' ' ASN . 5.3 t80 -94.69 -68.72 0.79 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.564 -0.532 . . . . 11.390000000000001 109.564 179.408 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 6.1 m -129.66 20.1 5.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.088 -0.505 . . . . 7.9000000000000004 110.252 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 33.7 t70 66.72 41.54 2.93 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.349 -0.842 . . . . 9.0800000000000001 111.19 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -96.2 140.06 31.45 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.403 -0.362 . . . . 7.71 110.258 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 63.5 mt -79.63 108.83 13.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.561 -0.533 . . . . 8.3800000000000008 109.561 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.401 ' H ' ' HG2' ' B' ' 104' ' ' GLU . 6.4 pt-20 -72.94 -45.18 59.52 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.519 -0.309 . . . . 8.8100000000000005 111.025 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -165.55 167.6 17.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.455 -0.339 . . . . 7.8200000000000003 110.382 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 67.5 mt -106.0 121.85 58.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.959 -0.564 . . . . 7.2199999999999998 110.155 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . 0.568 HG21 HG13 ' B' ' 13' ' ' ILE . 83.4 mt -87.75 100.03 9.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.893 -0.594 . . . . 6.7199999999999998 109.734 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 108' ' ' CYS . . . . . 0.492 ' HB3' HG22 ' B' ' 90' ' ' THR . 68.1 m -100.6 97.91 8.54 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 120.823 -0.351 . . . . 5.3099999999999996 111.522 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 46.3 m -75.36 99.29 4.08 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.121 -0.696 . . . . 5.8700000000000001 109.121 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 110' ' ' ASN . . . . . 0.529 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.3 m-20 -80.46 109.27 14.81 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.654 -0.703 . . . . 6.9000000000000004 110.899 -178.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 111' ' ' THR . . . . . 0.456 HG22 ' HB2' ' B' ' 11' ' ' GLU . 0.3 OUTLIER -113.09 110.88 21.19 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.114 -0.494 . . . . 8.9000000000000004 110.127 179.245 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 112' ' ' ASN . . . . . 0.707 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 10.8 t-20 -70.59 129.77 40.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.992 0.425 . . . . 11.84 110.754 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 38.8 t -106.36 -51.16 7.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.838 -0.619 . . . . 12.4 110.057 179.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . 0.439 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 34.4 mtpt . . . . . 0 C--O 1.246 0.889 0 CA-C-O 118.567 -0.73 . . . . 12.68 110.217 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.2 mm-40 . . . . . 0 C--O 1.234 0.288 0 N-CA-C 109.831 -0.433 . . . . 15.44 109.831 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.89 153.85 67.86 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.742 2.295 . . . . 14.109999999999999 112.751 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' THR . . . . . 0.788 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.2 OUTLIER -79.53 52.49 1.4 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.347 0.594 . . . . 11.369999999999999 111.079 179.609 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.482 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 40.8 tt0 -152.37 123.75 7.72 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.417 -0.81 . . . . 10.59 108.825 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.76 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 44.7 p90 -139.79 151.11 45.5 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.066 0.46 . . . . 9.1999999999999993 111.732 -178.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.64 HG13 HD13 ' B' ' 107' ' ' ILE . 0.0 OUTLIER -111.32 129.31 66.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.784 -0.644 . . . . 8.9399999999999995 109.866 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.5 m -134.32 139.29 45.57 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.316 0.579 . . . . 6.1100000000000003 112.35 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.59 ' HD2' ' HD2' ' A' ' 24' ' ' PHE . 6.5 mtt85 -89.54 133.37 34.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.161 -0.927 . . . . 9.4600000000000009 108.978 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.507 ' CB ' ' HA ' ' A' ' 22' ' ' PHE . 33.5 p80 -154.89 158.69 39.71 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.183 0.516 . . . . 10.369999999999999 111.751 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -65.85 155.7 35.53 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.992 -1.004 . . . . 13.279999999999999 109.278 178.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 18.4 pt -53.87 -31.02 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 N-CA-C 112.406 0.521 . . . . 13.970000000000001 112.406 -179.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -75.12 -16.59 60.53 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.821 0.343 . . . . 13.85 111.83 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 120.58 -19.48 9.08 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.308 -0.949 . . . . 9.6099999999999994 113.553 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.475 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 30.6 mm -57.5 110.36 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 116.829 0.314 . . . . 11.289999999999999 110.978 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.507 ' HA ' ' CB ' ' A' ' 16' ' ' HIS . 82.3 m-85 -71.95 138.78 48.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.973 0.416 . . . . 10.449999999999999 111.457 -179.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.6 m -115.4 -36.9 4.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.756 -0.656 . . . . 8.1300000000000008 110.891 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.59 ' HD2' ' HD2' ' A' ' 15' ' ' ARG . 18.6 t80 -139.48 110.7 6.95 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.409 -0.589 . . . . 7.4900000000000002 109.409 179.318 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.548 HG22 ' HB2' ' A' ' 40' ' ' LEU . 7.3 t -97.61 150.24 4.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 116.447 -0.342 . . . . 6.4500000000000002 110.776 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.76 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 7.8 t70 -69.35 172.58 6.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.704 -0.68 . . . . 7.3099999999999996 110.087 179.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -91.02 -21.38 21.3 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.124 0.488 . . . . 12.41 109.828 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 76.5 mtm180 -84.41 5.69 26.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.633 -0.712 . . . . 12.19 111.943 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 4.5 p -59.94 -42.92 95.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.323 0.582 . . . . 13.5 110.441 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.575 HG12 HE22 ' A' ' 36' ' ' GLN . 4.1 t -66.45 -28.88 44.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.522 -0.763 . . . . 16.559999999999999 111.04 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.24 -6.12 59.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.16 -0.473 . . . . 15.07 111.684 -179.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.452 ' HA ' HG21 ' A' ' 10' ' ' THR . 18.4 m -109.71 -56.99 2.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.724 0.297 . . . . 15.26 111.334 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.612 HG21 ' HB2' ' A' ' 35' ' ' TYR . 11.1 m -113.17 -19.61 6.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.704 0.288 . . . . 14.18 111.702 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 94.51 -8.84 71.73 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.462 -0.875 . . . . 13.85 112.359 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.612 ' HB2' HG21 ' A' ' 33' ' ' VAL . 4.6 m-85 -74.01 136.76 43.17 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.377 -0.231 . . . . 18.59 110.377 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.575 HE22 HG12 ' A' ' 30' ' ' VAL . 33.3 mm-40 -80.7 153.54 73.16 Favored Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 109.139 -0.689 . . . . 15.890000000000001 109.139 178.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.564 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 52.6 Cg_exo -53.56 -38.97 84.18 Favored 'Trans proline' 0 CA--C 1.529 0.237 0 C-N-CA 122.568 2.179 . . . . 12.26 112.712 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -71.11 -14.63 62.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.219 -0.446 . . . . 13.68 111.665 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.522 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 34.2 mt-10 -82.31 -20.65 36.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.911 0.386 . . . . 17.34 110.366 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.548 ' HB2' HG22 ' A' ' 25' ' ' VAL . 3.3 mm? -95.51 -24.11 16.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.771 -0.649 . . . . 13.56 110.495 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 82.5 mt -61.0 122.79 15.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.849 -0.614 . . . . 13.42 111.028 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . 0.411 ' HA2' HG23 ' A' ' 21' ' ' ILE . . . 76.31 9.18 85.82 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.879 -0.677 . . . . 13.390000000000001 112.586 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.726 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 9.0 mmpt? -114.1 153.39 29.57 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.908 0.385 . . . . 17.239999999999998 110.667 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.481 ' HB3' HG12 ' A' ' 46' ' ' VAL . 16.2 m120 -94.84 138.22 32.9 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.85 -0.613 . . . . 12.77 109.48 179.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.7 tt -61.14 -23.23 29.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.146 0.498 . . . . 12.050000000000001 110.856 179.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.481 HG12 ' HB3' ' A' ' 44' ' ' ASN . 11.5 p -70.8 -20.71 22.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 116.075 -0.511 . . . . 13.390000000000001 111.432 -179.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -72.75 -39.24 66.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.194 0.521 . . . . 16.530000000000001 110.461 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -97.36 19.44 13.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.679 -0.691 . . . . 15.83 110.396 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.638 ' HG ' HD12 ' A' ' 57' ' ' LEU . 49.8 t -104.56 149.5 25.45 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.837 -0.619 . . . . 12.01 110.513 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.4 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 4.9 t-160 -58.16 125.31 74.26 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.507 -0.77 . . . . 15.130000000000001 109.335 178.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.434 ' HA ' ' CD ' ' A' ' 54' ' ' GLN . 88.5 Cg_exo -48.89 -38.99 39.52 Favored 'Trans proline' 0 CA--C 1.533 0.452 0 C-N-CA 123.089 2.526 . . . . 15.83 113.823 -178.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -81.46 0.67 36.69 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.939 0.348 . . . . 16.690000000000001 111.939 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.4 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 36.7 m-20 -125.76 2.31 7.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.831 0.348 . . . . 13.16 110.978 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.434 ' CD ' ' HA ' ' A' ' 51' ' ' PRO . 85.5 mt-30 -61.99 -39.76 93.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.134 -0.484 . . . . 16.170000000000002 111.059 -179.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 -66.74 -44.38 81.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.262 -0.426 . . . . 14.35 110.211 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.2 tp -59.96 -41.97 93.08 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.218 -0.446 . . . . 12.51 110.37 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.638 HD12 ' HG ' ' A' ' 49' ' ' CYS . 0.2 OUTLIER -62.56 -53.09 59.91 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.003 -0.544 . . . . 10.08 110.114 179.307 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.414 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 52.7 ttt180 -59.77 -45.52 92.01 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.581 -0.736 . . . . 11.710000000000001 111.412 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -58.58 -46.72 86.32 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.335 -0.393 . . . . 9.7100000000000009 111.025 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.3 m -66.46 -33.65 76.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.201 -0.454 . . . . 9.5199999999999996 110.812 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.476 ' O ' HG12 ' A' ' 64' ' ' VAL . 1.8 m-30 -64.44 -30.08 71.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.065 0.459 . . . . 12.109999999999999 109.924 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.414 ' HG2' ' O ' ' A' ' 58' ' ' ARG . 18.7 mm100 -79.13 -31.72 44.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.855 -0.611 . . . . 10.289999999999999 110.236 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -66.49 -42.49 87.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.876 -0.602 . . . . 10.619999999999999 110.972 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.476 HG12 ' O ' ' A' ' 61' ' ' PHE . 9.5 p -64.01 -25.98 39.43 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-O 121.011 0.434 . . . . 10.93 110.399 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.475 ' HA ' HG21 ' A' ' 94' ' ' THR . 82.7 t -72.58 -38.31 58.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 109.382 -0.599 . . . . 12.890000000000001 109.382 178.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 41.5 mtpt -68.98 -40.81 78.57 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.717 -0.674 . . . . 16.68 110.022 179.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.673 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 86.9 mt -62.57 -49.63 74.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.669 -0.696 . . . . 13.18 110.75 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 62.5 mttt 66.01 99.37 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.815 -0.63 . . . . 15.17 112.394 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 82.16 14.37 77.04 Favored Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 121.029 -0.605 . . . . 10.01 113.356 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.673 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 7.3 tp-100 -119.74 123.62 44.19 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.551 -0.537 . . . . 10.039999999999999 109.551 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 6.8 p -71.35 126.32 31.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.297 0.57 . . . . 8.5399999999999991 111.128 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 22.4 tp -115.73 123.97 49.64 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.811 -0.631 . . . . 8.1300000000000008 109.706 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -92.54 116.7 29.23 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.085 -0.507 . . . . 7.8899999999999997 111.262 -179.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.1 p -119.56 122.8 69.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.106 0.479 . . . . 8.1799999999999997 110.253 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 11.7 ttt -100.36 127.31 46.71 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.259 -0.428 . . . . 9.6999999999999993 111.172 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.502 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 45.3 p90 -154.18 -179.57 8.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.915 -0.584 . . . . 10.27 109.755 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.445 ' HD2' ' HB3' ' A' ' 85' ' ' TRP . 11.4 mtm180 -100.86 119.83 39.25 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.907 0.384 . . . . 13.859999999999999 109.987 179.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.502 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 21.5 t80 -104.9 150.59 24.74 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.883 -0.598 . . . . 9.7300000000000004 110.475 -179.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.538 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 28.3 ttp180 -86.5 133.08 33.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.323 -0.399 . . . . 11.300000000000001 110.573 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 59.8 p -93.11 -175.36 3.83 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.675 -0.491 . . . . 11.039999999999999 109.675 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.436 ' HD2' ' HA ' ' A' ' 81' ' ' LYS . 37.6 tptt -72.24 -14.65 61.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.25 0.548 . . . . 13.18 109.704 178.514 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -95.48 5.23 52.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.729 -0.668 . . . . 14.890000000000001 109.768 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 68.08 23.58 8.02 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.162 -0.926 . . . . 12.92 112.018 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.467 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.5 pt-20 -94.01 161.88 14.11 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.789 -0.449 . . . . 10.94 109.789 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.538 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 81.7 m95 -107.16 106.16 16.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.816 0.341 . . . . 11.77 110.288 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.464 HD21 HG12 ' A' ' 33' ' ' VAL . 1.6 pp -105.78 148.67 27.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.198 -0.455 . . . . 11.57 110.866 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.671 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 96.3 m95 -81.29 117.18 21.57 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.294 -0.412 . . . . 10.73 110.068 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.481 ' SD ' ' HB3' ' A' ' 110' ' ' ASN . 3.7 ttp -130.61 141.52 50.44 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.255 -0.43 . . . . 9.7400000000000002 111.193 -179.015 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -103.25 100.49 10.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.717 -0.674 . . . . 11.16 109.323 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.516 HG22 ' HB3' ' A' ' 108' ' ' CYS . 37.7 m -82.91 113.93 20.85 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.247 0.546 . . . . 9.5899999999999999 111.511 -179.289 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.684 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 0.7 OUTLIER -91.78 91.15 7.81 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.688 -0.856 . . . . 8.8800000000000008 108.688 178.382 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.1 m -82.0 131.07 35.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.075 -0.511 . . . . 8.9399999999999995 111.896 -178.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -127.12 121.6 31.88 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.771 -0.65 . . . . 12.1 109.812 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.475 HG21 ' HA ' ' A' ' 65' ' ' VAL . 0.0 OUTLIER -76.31 111.28 11.58 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.911 0.386 . . . . 10.16 110.695 179.717 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -81.44 100.73 9.44 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.136 0.493 . . . . 12.6 110.049 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.477 ' HG2' HG12 ' A' ' 103' ' ' ILE . 37.4 mt-30 -90.2 152.99 20.84 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.732 -0.667 . . . . 14.6 111.31 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.425 ' OD1' ' HB2' ' A' ' 99' ' ' TYR . 15.6 t-20 -102.82 130.35 23.99 Favored Pre-proline 0 C--N 1.32 -0.684 0 CA-C-N 115.427 -0.806 . . . . 13.83 109.046 179.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -76.22 54.62 4.29 Favored 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.576 2.184 . . . . 15.34 112.876 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.425 ' HB2' ' OD1' ' A' ' 97' ' ' ASN . 4.3 t80 -125.95 -55.25 1.49 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 16.890000000000001 110.348 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -138.41 22.2 2.75 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.983 -0.553 . . . . 15.140000000000001 109.746 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 10.0 t70 63.29 33.23 14.24 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.59 -0.732 . . . . 14.94 110.021 -179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -90.45 162.58 15.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.92 -0.582 . . . . 12.949999999999999 110.289 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.477 HG12 ' HG2' ' A' ' 96' ' ' GLN . 43.8 mt -110.58 119.85 60.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.78 -0.452 . . . . 11.44 109.78 179.406 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.81 -40.76 27.85 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.856 -0.338 . . . . 11.65 110.737 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 14.4 p90 -169.16 -178.18 3.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.258 -0.428 . . . . 10.35 110.209 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 73.0 mt -121.59 127.16 75.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.876 0.37 . . . . 10.470000000000001 110.88 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.535 HG22 HG22 ' A' ' 13' ' ' ILE . 19.3 mt -99.62 122.3 51.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 108.623 -0.88 . . . . 9.3200000000000003 108.623 178.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.516 ' HB3' HG22 ' A' ' 90' ' ' THR . 81.5 m -110.26 132.21 54.37 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.255 0.55 . . . . 10.15 112.452 -178.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.684 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 12.8 m -100.27 95.8 7.03 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.776 -1.102 . . . . 11.4 108.447 178.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.482 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 6.7 m-20 -81.93 105.85 13.38 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.093 -0.503 . . . . 11.640000000000001 111.839 -178.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 1.7 m -102.3 112.56 25.31 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.802 -0.635 . . . . 11.220000000000001 110.085 178.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . 0.788 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 10.0 t-20 -72.47 125.28 27.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.905 0.383 . . . . 12.98 110.55 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 46.4 t -102.98 -50.21 9.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.158 -0.474 . . . . 15.109999999999999 109.897 179.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.671 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 89.8 mttt . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.283 -0.865 . . . . 16.32 110.09 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 80.3 m . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 109.939 -0.393 . . . . 7.8399999999999999 109.939 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -133.74 146.32 59.76 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 116.646 -0.252 . . . . 7.4900000000000002 110.537 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' PRO . . . . . 0.692 ' HD2' ' HG2' ' B' ' 28' ' ' ARG . 18.1 Cg_exo -67.54 167.57 20.46 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 123.025 2.483 . . . . 6.4400000000000004 112.104 179.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.97 57.89 3.62 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.479 0.656 . . . . 5.9800000000000004 111.136 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.496 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -166.62 148.62 6.46 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.315 -0.995 . . . . 5.8499999999999996 108.315 179.043 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 47.7 p90 -156.21 162.74 40.14 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.422 0.629 . . . . 6.4900000000000002 112.06 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . 0.677 HG21 HG21 ' B' ' 107' ' ' ILE . 27.0 mm -96.33 117.35 40.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 114.912 -1.04 . . . . 6.0199999999999996 110.409 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.447 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.9 OUTLIER -106.86 101.86 11.26 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.005 -0.543 . . . . 5.3700000000000001 110.831 -179.769 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . 0.545 ' HD3' ' HB3' ' B' ' 24' ' ' PHE . 26.8 mtp85 -91.94 108.01 19.62 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.175 -0.676 . . . . 9.4600000000000009 109.175 179.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . 0.528 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 31.9 p80 -139.55 164.46 29.84 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.345 -0.389 . . . . 8.3100000000000005 110.897 -178.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 10.8 p-10 -75.71 -177.83 3.92 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.408 -0.36 . . . . 11.19 110.48 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 33.9 pt -65.64 -28.17 43.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 112.455 0.539 . . . . 9.3699999999999992 112.455 -178.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -72.69 -32.75 66.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.724 0.297 . . . . 11.92 110.934 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 125.58 -11.4 7.52 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.578 -0.82 . . . . 8.6799999999999997 112.267 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 39.3 mm -62.12 112.64 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.775 0.321 . . . . 11.16 110.388 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . 0.528 ' HA ' ' HB3' ' B' ' 16' ' ' HIS . 97.2 m-85 -69.81 129.68 40.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.97 -0.559 . . . . 8.5999999999999996 111.279 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.85 -33.91 7.82 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.82 -0.627 . . . . 7.9100000000000001 110.607 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . 0.545 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 37.8 t80 -152.05 124.69 8.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.33 -0.396 . . . . 8.5 110.483 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 4.8 t -125.88 141.11 46.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.077 -0.511 . . . . 6.5 109.973 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -73.68 159.81 32.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.899 0.381 . . . . 7.1500000000000004 110.222 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 35.8 m80 -69.28 -10.34 57.39 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.088 -0.506 . . . . 9.4100000000000001 112.036 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . 0.692 ' HG2' ' HD2' ' B' ' 9' ' ' PRO . 60.9 mtm180 -67.1 -20.06 65.73 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.429 0.529 . . . . 9.7599999999999998 112.429 -179.202 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 32.1 p -59.75 -29.86 68.45 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.144 0.424 . . . . 11.56 112.144 -178.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . 0.676 HG12 HE22 ' B' ' 36' ' ' GLN . 21.8 t -61.94 -37.57 78.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.216 -0.447 . . . . 14.01 112.059 -178.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -91.85 -12.65 33.05 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.019 0.438 . . . . 12.9 111.181 -179.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 16.3 m -88.14 -64.71 1.1 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.252 -0.431 . . . . 12.34 111.368 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' VAL . . . . . 0.462 HG23 ' H ' ' B' ' 35' ' ' TYR . 6.9 m -108.64 -13.0 10.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.755 0.312 . . . . 13.869999999999999 111.614 -179.215 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' GLY . . . . . 0.432 ' HA2' ' O ' ' B' ' 30' ' ' VAL . . . 89.65 -12.68 66.32 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.573 -0.822 . . . . 14.369999999999999 112.003 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' TYR . . . . . 0.462 ' H ' HG23 ' B' ' 33' ' ' VAL . 14.9 m-85 -73.12 141.2 47.49 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.682 0.277 . . . . 15.56 110.632 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . 0.676 HE22 HG12 ' B' ' 30' ' ' VAL . 34.7 mm-40 -84.64 148.65 52.31 Favored Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 108.902 -0.777 . . . . 13.859999999999999 108.902 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.702 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 52.4 Cg_exo -52.63 -39.78 74.91 Favored 'Trans proline' 0 N--CA 1.465 -0.153 0 C-N-CA 122.301 2.001 . . . . 15.210000000000001 111.986 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 26.0 mp0 -65.9 -20.24 66.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.938 -0.573 . . . . 17.82 112.22 -179.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.55 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 42.6 mt-10 -79.15 -39.35 33.74 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.892 -0.41 . . . . 14.42 109.892 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' B' ' 40' ' ' LEU . 1.5 mm? -73.41 -34.21 65.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.905 -0.589 . . . . 14.550000000000001 111.207 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . 0.702 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 56.6 mt -59.18 114.66 2.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.96 0.409 . . . . 14.050000000000001 111.304 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 98.32 -7.72 62.11 Favored Glycine 0 N--CA 1.45 -0.422 0 CA-C-N 115.825 -0.625 . . . . 11.68 112.44 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.467 ' HA ' ' HE2' ' B' ' 43' ' ' LYS . 1.4 mmpt? -108.47 166.68 10.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.74 0.305 . . . . 14.17 110.925 -179.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' ASN . . . . . 0.782 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 12.8 m120 -103.04 149.33 24.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.801 -0.636 . . . . 10.74 109.959 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 18.9 tt -71.48 -27.34 28.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.957 0.408 . . . . 9.8800000000000008 110.819 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 9.9 p -71.76 -20.53 20.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-O 120.986 0.422 . . . . 11.779999999999999 111.413 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . 0.782 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 41.8 mt-10 -70.52 -34.47 72.34 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.254 -0.43 . . . . 11.890000000000001 110.98 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -103.08 26.3 8.39 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.109 -0.496 . . . . 14.279999999999999 110.147 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 49.8 t -107.57 152.55 24.11 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.001 -0.545 . . . . 10.81 111.082 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' HIS . . . . . 0.434 ' HB2' ' HB2' ' B' ' 77' ' ' ARG . 8.8 t-80 -63.92 130.29 94.38 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 115.401 -0.818 . . . . 12.029999999999999 109.538 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' PRO . . . . . 0.424 ' HD2' ' CD2' ' B' ' 50' ' ' HIS . 85.9 Cg_exo -43.53 -51.18 6.28 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.606 2.871 . . . . 11.869999999999999 114.438 -179.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -72.98 -3.91 28.96 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.375 0.509 . . . . 9.2799999999999994 112.375 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . 0.58 ' HB3' ' HB2' ' B' ' 76' ' ' PHE . 14.8 m-20 -118.35 3.86 11.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.986 0.422 . . . . 7.5199999999999996 110.692 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -68.2 -48.23 65.79 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.919 -0.582 . . . . 6.5700000000000003 111.524 -178.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 49.7 tp60 -65.23 -33.49 76.12 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.858 -0.423 . . . . 6.9900000000000002 109.858 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 22.0 tp -61.38 -39.23 89.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.963 -0.562 . . . . 5.1399999999999997 109.993 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 1.1 mt -66.39 -47.47 73.23 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.786 -0.643 . . . . 6.8200000000000003 110.272 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -61.95 -46.09 90.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.807 -0.633 . . . . 8.6899999999999995 111.036 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -58.95 -45.68 89.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.47 . . . . 6.46 111.056 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 15.7 m -66.84 -36.4 82.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.247 -0.433 . . . . 5.5899999999999999 110.869 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 61' ' ' PHE . . . . . 0.617 ' O ' HG12 ' B' ' 64' ' ' VAL . 1.7 m-30 -64.64 -42.8 95.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.732 0.301 . . . . 8.3300000000000001 110.539 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -65.17 -28.75 69.62 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.079 0.466 . . . . 7.1500000000000004 110.405 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -76.82 -37.86 54.94 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.993 -0.549 . . . . 9.5299999999999994 111.021 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.718 ' HA ' HD12 ' B' ' 67' ' ' LEU . 2.8 p -65.74 -27.46 41.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 CA-C-O 120.775 0.321 . . . . 8.2200000000000006 110.474 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . 0.437 HG23 ' O ' ' B' ' 61' ' ' PHE . 92.4 t -69.77 -34.77 62.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.327 0.585 . . . . 7.4299999999999997 109.605 178.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -80.27 -18.26 49.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.636 -0.711 . . . . 10.52 110.439 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.817 ' HB3' ' HB2' ' B' ' 70' ' ' GLN . 64.8 mt -74.3 -46.92 38.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.862 -0.608 . . . . 7.5300000000000002 110.572 179.326 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 86.2 mttt 56.6 88.46 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.85 0.719 . . . . 8.0099999999999998 112.538 179.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.55 -4.0 63.73 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.431 -0.89 . . . . 5.8700000000000001 112.533 178.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . 0.817 ' HB2' ' HB3' ' B' ' 67' ' ' LEU . 2.3 mp0 -104.68 141.53 36.28 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 110.164 -0.31 . . . . 5.6299999999999999 110.164 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 71' ' ' VAL . . . . . 0.82 ' HB ' ' HD1' ' B' ' 93' ' ' PHE . 7.1 p -92.94 132.33 37.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.151 0.5 . . . . 6.0599999999999996 111.054 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 14.9 tp -119.98 111.73 18.28 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.917 -0.583 . . . . 4.9299999999999997 109.435 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 73' ' ' SER . . . . . 0.62 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.2 p -91.24 110.29 21.57 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.208 -0.451 . . . . 6.79 110.926 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.1 p -103.83 128.69 56.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.122 -0.49 . . . . 4.4199999999999999 110.107 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 28.4 ttt -99.29 109.11 21.78 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.366 -0.379 . . . . 5.6699999999999999 110.292 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.58 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 51.5 p90 -138.6 -173.64 3.61 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.058 -0.519 . . . . 3.75 110.121 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 77' ' ' ARG . . . . . 0.434 ' HB2' ' HB2' ' B' ' 50' ' ' HIS . 26.3 mtt180 -106.64 115.61 30.49 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.754 0.311 . . . . 7.3499999999999996 110.32 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -102.64 149.45 24.43 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.035 -0.53 . . . . 5.79 110.021 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 79' ' ' ARG . . . . . 0.581 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 17.5 ttp180 -88.88 133.06 34.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.925 0.393 . . . . 11.529999999999999 110.618 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 80' ' ' SER . . . . . 0.496 ' HG ' ' HG2' ' B' ' 84' ' ' GLU . 91.0 p -94.58 -176.33 3.88 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.683 -0.488 . . . . 7.4699999999999998 109.683 178.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . 0.416 ' HA ' ' HD2' ' B' ' 81' ' ' LYS . 40.2 tptt -68.26 -16.22 63.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.27 0.557 . . . . 12.67 110.014 179.077 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -88.11 -0.54 57.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.678 -0.692 . . . . 9.25 109.884 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 65.93 28.78 10.54 Favored 'General case' 0 C--N 1.334 -0.076 0 CA-C-N 115.551 -0.75 . . . . 8.75 110.795 -179.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . 0.496 ' HG2' ' HG ' ' B' ' 80' ' ' SER . 12.2 pt-20 -106.53 163.72 12.65 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.031 -0.729 . . . . 6.8700000000000001 109.031 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . 0.581 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 49.9 m95 -105.15 127.76 53.06 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.135 0.493 . . . . 8.3800000000000008 111.426 -179.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -129.26 151.3 50.06 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.792 -0.64 . . . . 7.25 109.814 179.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 87' ' ' TRP . . . . . 0.534 ' HD1' ' HB2' ' B' ' 114' ' ' LYS . 98.8 m95 -75.65 111.57 11.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.358 0.599 . . . . 9.3000000000000007 110.511 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 88' ' ' MET . . . . . 0.415 ' SD ' ' HB3' ' B' ' 110' ' ' ASN . 47.0 tpp -116.0 123.44 48.01 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.248 -0.887 . . . . 4.46 110.722 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 33.3 ttp180 -97.76 83.27 3.16 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.592 -0.892 . . . . 7.3099999999999996 108.592 178.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 90' ' ' THR . . . . . 0.628 HG22 ' HB3' ' B' ' 108' ' ' CYS . 36.2 m -72.06 109.45 5.87 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.418 -0.81 . . . . 6.1799999999999997 111.231 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 91' ' ' SER . . . . . 0.666 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 1.9 m -90.38 87.89 6.97 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.697 -0.683 . . . . 6.4500000000000002 109.339 179.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 92' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' B' ' 108' ' ' CYS . 9.2 m -75.39 120.46 20.87 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.84 -0.618 . . . . 6.75 111.517 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . 0.82 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 55.8 t80 -116.88 124.22 48.94 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.943 -0.572 . . . . 6.4500000000000002 110.085 179.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 94' ' ' THR . . . . . 0.515 HG23 HG21 ' B' ' 103' ' ' ILE . 0.3 OUTLIER -83.69 103.26 12.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.881 0.372 . . . . 9.8800000000000008 110.691 179.76 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 95' ' ' PHE . . . . . 0.467 ' CZ ' ' HB ' ' A' ' 13' ' ' ILE . 0.0 OUTLIER -74.62 117.17 16.15 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.156 -0.474 . . . . 8.9100000000000001 110.52 -179.647 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -83.25 116.91 22.62 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.751 -0.659 . . . . 10.99 110.584 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 97' ' ' ASN . . . . . 0.489 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 62.7 t30 -80.74 127.84 73.83 Favored Pre-proline 0 C--N 1.322 -0.625 0 N-CA-C 109.251 -0.648 . . . . 8.5099999999999998 109.251 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 98' ' ' PRO . . . . . 0.489 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 23.5 Cg_endo -62.32 73.27 0.11 Allowed 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.257 2.638 . . . . 9.1600000000000001 113.054 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . 0.494 ' HB3' ' H ' ' B' ' 100' ' ' SER . 3.6 m-85 -147.4 -137.58 0.09 Allowed 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.818 -0.808 . . . . 11.390000000000001 108.818 179.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 100' ' ' SER . . . . . 0.494 ' H ' ' HB3' ' B' ' 99' ' ' TYR . 0.3 OUTLIER -80.54 49.3 1.15 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.665 0.269 . . . . 7.9000000000000004 110.968 179.437 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 38.8 t70 50.53 77.0 0.13 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.719 -0.673 . . . . 9.0800000000000001 111.101 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . 0.433 ' HG3' ' HB3' ' B' ' 97' ' ' ASN . 3.4 pt-20 -133.43 151.46 51.8 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.946 0.403 . . . . 7.71 111.459 -179.143 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 103' ' ' ILE . . . . . 0.515 HG21 HG23 ' B' ' 94' ' ' THR . 40.2 mt -94.9 98.3 7.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.638 -0.71 . . . . 8.3800000000000008 109.146 178.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -58.45 -47.8 82.8 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.985 -0.552 . . . . 8.8100000000000005 110.723 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 8.1 p90 -161.31 163.49 30.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.104 -0.498 . . . . 7.8200000000000003 110.133 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 62.6 mt -105.16 114.32 44.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.896 -0.593 . . . . 7.2199999999999998 109.686 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . 0.677 HG21 HG21 ' B' ' 13' ' ' ILE . 88.1 mt -86.87 104.21 13.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.008 -0.542 . . . . 6.7199999999999998 109.697 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 108' ' ' CYS . . . . . 0.628 ' HB3' HG22 ' B' ' 90' ' ' THR . 75.6 m -94.43 108.49 20.41 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.967 -0.561 . . . . 5.3099999999999996 111.632 -179.179 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 109' ' ' THR . . . . . 0.666 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 27.5 m -82.47 90.94 6.79 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.94 -0.763 . . . . 5.8700000000000001 108.94 177.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 110' ' ' ASN . . . . . 0.468 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.0 m-20 -72.24 106.86 4.59 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.836 -0.62 . . . . 6.9000000000000004 111.363 -178.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 1.4 m -108.72 109.03 20.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.308 -0.406 . . . . 8.9000000000000004 110.189 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -70.95 127.07 31.35 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.987 0.422 . . . . 11.84 110.586 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 113' ' ' VAL . . . . . 0.403 HG11 ' HG3' ' B' ' 114' ' ' LYS . 35.2 t -100.23 -55.46 5.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.769 -0.65 . . . . 12.4 109.751 179.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . 0.534 ' HB2' ' HD1' ' B' ' 87' ' ' TRP . 45.4 mtpt . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.516 -0.754 . . . . 12.68 109.703 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.7 mm-40 . . . . . 0 N--CA 1.454 -0.265 0 N-CA-C 109.689 -0.485 . . . . 15.44 109.689 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.65 164.85 34.41 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.769 2.312 . . . . 14.109999999999999 112.556 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' THR . . . . . 0.698 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.2 OUTLIER -82.89 52.0 2.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.154 0.502 . . . . 11.369999999999999 110.975 179.737 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.411 ' HB2' HG21 ' A' ' 111' ' ' THR . 40.2 tt0 -156.41 129.97 8.26 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.782 -0.645 . . . . 10.59 109.479 -179.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.929 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 39.4 p90 -144.83 145.11 31.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.937 0.399 . . . . 9.1999999999999993 111.425 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.496 HG21 HG21 ' A' ' 107' ' ' ILE . 2.5 mp -93.57 117.93 38.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 109.795 -0.446 . . . . 8.9399999999999995 109.795 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 52.8 p -105.16 121.97 44.94 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.233 0.539 . . . . 6.1100000000000003 111.057 -179.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.9 mtp180 -97.85 102.9 14.77 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.303 -0.999 . . . . 9.4600000000000009 108.303 178.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 31.8 p80 -130.46 153.85 48.36 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.511 -0.313 . . . . 10.369999999999999 110.931 -178.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -69.18 173.98 5.1 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.475 -0.329 . . . . 13.279999999999999 110.236 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.0 pt -58.83 -29.51 40.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 112.802 0.667 . . . . 13.970000000000001 112.802 -178.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -73.94 -21.38 60.06 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.887 0.375 . . . . 13.85 111.465 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 112.12 -0.93 26.92 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 120.436 -0.888 . . . . 9.6099999999999994 112.509 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.42 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 40.2 mm -72.98 118.45 18.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.679 -0.489 . . . . 11.289999999999999 109.679 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.406 ' CG ' ' HB3' ' A' ' 40' ' ' LEU . 86.9 m-85 -69.41 113.63 6.89 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.183 -0.462 . . . . 10.449999999999999 111.507 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.83 -35.95 23.85 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.355 0.598 . . . . 8.1300000000000008 109.659 178.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -152.78 125.85 8.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.312 -0.858 . . . . 7.4900000000000002 108.985 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.606 HG21 ' HB2' ' A' ' 40' ' ' LEU . 2.5 t -110.35 147.88 14.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.953 0.406 . . . . 6.4500000000000002 111.414 -178.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.929 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 6.4 t70 -68.81 168.9 12.46 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.874 -0.603 . . . . 7.3099999999999996 109.764 179.145 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 60.5 m170 -95.34 -11.96 26.9 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.995 0.426 . . . . 12.41 110.574 -179.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 85.6 mtm180 -82.0 -5.94 58.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.895 -0.593 . . . . 12.19 111.947 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.6 p -60.88 -27.37 68.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.867 0.365 . . . . 13.5 111.163 -179.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.492 HG12 HE22 ' A' ' 36' ' ' GLN . 15.0 t -65.14 -32.67 59.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.045 -0.525 . . . . 16.559999999999999 110.823 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.52 -27.19 21.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.182 -0.463 . . . . 15.07 110.787 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.561 ' HA ' HG21 ' A' ' 10' ' ' THR . 4.0 m -76.63 -55.37 5.57 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.114 -0.494 . . . . 15.26 111.376 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.551 HG13 ' HD2' ' A' ' 78' ' ' PHE . 2.7 m -120.13 -30.07 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 111.871 0.322 . . . . 14.18 111.871 -179.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.431 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 110.48 -23.57 19.91 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.307 -0.949 . . . . 13.85 112.015 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -65.58 135.86 55.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.743 0.306 . . . . 18.59 110.529 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.63 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 48.7 mm-40 -77.3 150.41 80.11 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 109.16 -0.682 . . . . 15.890000000000001 109.16 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.573 ' HB3' ' HB ' ' A' ' 25' ' ' VAL . 53.6 Cg_exo -52.36 -40.0 71.82 Favored 'Trans proline' 0 CA--C 1.528 0.202 0 C-N-CA 122.443 2.095 . . . . 12.26 112.05 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.557 ' HA ' HD12 ' A' ' 41' ' ' LEU . 25.7 mp0 -65.6 -20.34 66.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.621 -0.718 . . . . 13.68 111.612 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.63 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 29.3 mt-10 -78.74 -28.14 44.89 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.146 -0.316 . . . . 17.34 110.146 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.606 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.7 mm? -86.58 -26.9 24.23 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.879 -0.601 . . . . 13.56 110.791 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.557 HD12 ' HA ' ' A' ' 38' ' ' GLN . 96.7 mt -60.43 119.34 7.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.106 -0.497 . . . . 13.42 110.824 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.9 3.8 82.8 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 121.01 -0.614 . . . . 13.390000000000001 112.41 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.498 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 8.3 mmpt? -113.95 161.2 17.95 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.224 -0.287 . . . . 17.239999999999998 110.224 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.633 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 16.8 m120 -98.06 136.37 38.41 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.669 -0.493 . . . . 12.77 109.669 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.479 HD12 ' HZ ' ' A' ' 61' ' ' PHE . 13.8 tt -58.8 -27.55 35.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.106 0.479 . . . . 12.050000000000001 110.992 179.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.2 p -71.21 -18.68 20.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.051 -0.522 . . . . 13.390000000000001 111.56 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.633 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.0 mt-10 -71.14 -34.63 71.21 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.035 0.445 . . . . 16.530000000000001 110.901 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -100.45 24.14 9.31 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.903 -0.59 . . . . 15.83 110.471 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 46.0 t -110.57 150.19 29.3 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.059 -0.519 . . . . 12.01 110.063 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.522 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 6.8 t-160 -58.33 125.17 74.51 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 109.133 -0.691 . . . . 15.130000000000001 109.133 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_exo -45.63 -46.36 15.04 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 123.189 2.592 . . . . 15.83 113.679 -179.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -75.82 0.03 19.48 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.121 0.415 . . . . 16.690000000000001 112.121 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.522 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 9.5 m-20 -122.03 -0.17 9.54 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.963 0.411 . . . . 13.16 110.246 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -63.9 -45.47 89.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.791 -0.64 . . . . 16.170000000000002 111.557 -179.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.7 tp60 -66.46 -37.0 84.18 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.433 -0.58 . . . . 14.35 109.433 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.8 tp -59.48 -42.1 91.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.727 -0.67 . . . . 12.51 109.445 178.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.404 HD22 ' HA ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -67.73 -51.24 51.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.521 -0.763 . . . . 10.08 110.327 179.159 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -57.29 -47.22 82.03 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.767 -0.651 . . . . 11.710000000000001 111.606 -179.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.464 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 31.3 t70 -58.96 -45.89 89.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.32 -0.4 . . . . 9.7100000000000009 110.983 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.4 m -65.87 -33.27 75.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.966 -0.561 . . . . 9.5199999999999996 111.022 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.592 ' O ' HG12 ' A' ' 64' ' ' VAL . 1.9 m-85 -62.88 -39.47 94.54 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.051 0.453 . . . . 12.109999999999999 110.163 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -70.22 -32.0 69.68 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.043 -0.526 . . . . 10.289999999999999 110.092 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.628 ' HA ' ' HD3' ' A' ' 66' ' ' LYS . 65.7 mt-30 -66.08 -39.02 89.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.95 -0.568 . . . . 10.619999999999999 111.219 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.592 HG12 ' O ' ' A' ' 61' ' ' PHE . 2.3 p -68.14 -25.38 31.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.854 0.359 . . . . 10.93 110.687 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.415 ' O ' ' HG3' ' A' ' 68' ' ' LYS . 86.6 t -73.6 -34.82 42.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 N-CA-C 109.157 -0.683 . . . . 12.890000000000001 109.157 178.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.628 ' HD3' ' HA ' ' A' ' 63' ' ' GLN . 45.3 mtpt -72.23 -38.99 68.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.518 -0.765 . . . . 16.68 109.634 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.49 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 65.9 mt -66.01 -53.49 38.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.296 -0.865 . . . . 13.18 111.034 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.415 ' HG3' ' O ' ' A' ' 65' ' ' VAL . 62.7 mttt 60.33 91.46 0.05 Allowed 'General case' 0 N--CA 1.466 0.326 0 O-C-N 123.658 0.599 . . . . 15.17 112.38 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 105.74 -13.6 46.15 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.726 -0.75 . . . . 10.01 112.804 179.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.49 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 6.3 tp-100 -96.67 126.25 41.7 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.269 -0.271 . . . . 10.039999999999999 110.269 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.444 ' HA ' ' O ' ' A' ' 92' ' ' SER . 2.4 p -80.75 112.93 19.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.333 0.587 . . . . 8.5399999999999991 110.587 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.3 tp -104.29 117.33 33.94 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.616 -0.72 . . . . 8.1300000000000008 110.398 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.76 106.93 18.39 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.863 -0.608 . . . . 7.8899999999999997 111.193 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.445 HG12 ' HB ' ' A' ' 90' ' ' THR . 2.6 p -101.28 122.98 54.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.112 0.482 . . . . 8.1799999999999997 109.867 179.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 23.6 ttt -99.78 118.42 36.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.243 -0.435 . . . . 9.6999999999999993 110.954 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.592 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 45.4 p90 -145.9 -171.65 3.75 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.663 -0.699 . . . . 10.27 109.279 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.44 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 44.9 mtm180 -110.55 120.12 41.39 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.055 0.455 . . . . 13.859999999999999 110.398 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.592 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 12.7 t80 -102.25 151.88 21.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.316 -0.856 . . . . 9.7300000000000004 110.15 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.484 ' HA ' ' O ' ' A' ' 84' ' ' GLU . 37.9 ttp180 -88.61 128.16 35.58 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.171 -0.468 . . . . 11.300000000000001 110.471 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.46 ' HA ' ' HB ' ' A' ' 33' ' ' VAL . 54.9 p -88.47 -176.25 5.25 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.299 -0.41 . . . . 11.039999999999999 110.025 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.4 tptt -72.33 -14.23 61.69 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.104 -0.702 . . . . 13.18 109.104 178.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -90.74 1.38 56.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.316 -0.856 . . . . 14.890000000000001 109.489 178.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 67.82 22.91 8.63 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.207 -0.906 . . . . 12.92 111.316 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.484 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.5 pt-20 -96.1 167.95 10.9 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.755 -0.461 . . . . 10.94 109.755 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.466 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 77.2 m95 -108.92 108.31 19.02 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.582 -0.281 . . . . 11.77 110.562 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.502 HD21 HG12 ' A' ' 33' ' ' VAL . 2.6 pp -110.0 151.09 27.58 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.488 -0.324 . . . . 11.57 110.365 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.55 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 96.9 m95 -77.59 119.66 21.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.039 0.447 . . . . 10.73 110.527 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.437 ' SD ' ' HB3' ' A' ' 110' ' ' ASN . 30.5 tpp -119.2 135.41 54.69 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.776 -0.647 . . . . 9.7400000000000002 111.063 -178.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -104.72 81.69 1.8 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.65 -0.87 . . . . 11.16 108.65 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.587 HG22 ' HB3' ' A' ' 108' ' ' CYS . 28.7 m -71.38 109.51 5.41 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.689 -0.687 . . . . 9.5899999999999999 111.963 -178.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.493 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 0.7 OUTLIER -87.51 93.42 9.41 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.431 -0.804 . . . . 8.8800000000000008 108.982 178.697 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.444 ' O ' ' HA ' ' A' ' 71' ' ' VAL . 16.4 m -81.91 124.02 29.35 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.04 0.448 . . . . 8.9399999999999995 111.452 -178.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -125.63 125.06 42.52 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.746 -0.661 . . . . 12.1 109.93 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.69 129.51 37.22 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.297 -0.411 . . . . 10.16 111.474 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -114.04 109.97 19.29 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.376 -0.375 . . . . 12.6 110.079 179.496 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.55 152.91 28.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.997 0.427 . . . . 14.6 110.966 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -92.37 145.87 31.43 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 109.15 -0.685 . . . . 13.83 109.15 178.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.15 28.61 0.36 Allowed 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 122.65 2.233 . . . . 15.34 113.288 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -98.7 -64.69 1.01 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.145 0.498 . . . . 16.890000000000001 110.001 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.42 ' HB2' ' HG3' ' A' ' 102' ' ' GLU . 49.5 m -133.24 17.98 4.06 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.686 -0.688 . . . . 15.140000000000001 109.648 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.9 t70 63.62 34.16 12.62 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.272 -0.877 . . . . 14.94 109.811 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.42 ' HG3' ' HB2' ' A' ' 100' ' ' SER . 0.1 OUTLIER -80.3 130.22 35.04 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.181 -0.918 . . . . 12.949999999999999 110.154 -179.796 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 36.7 mt -81.15 106.74 12.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.872 -0.418 . . . . 11.44 109.872 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -70.58 -43.81 68.65 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.728 0.299 . . . . 11.65 110.328 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 31.6 p90 -165.5 172.4 12.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.211 -0.449 . . . . 10.35 110.295 178.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 52.1 mt -110.86 122.76 65.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.106 -0.497 . . . . 10.470000000000001 110.529 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.496 HG21 HG21 ' A' ' 13' ' ' ILE . 87.4 mt -84.56 110.72 19.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.311 -0.626 . . . . 9.3200000000000003 109.311 179.163 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.587 ' HB3' HG22 ' A' ' 90' ' ' THR . 64.5 m -110.79 109.37 19.56 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.143 0.497 . . . . 10.15 111.505 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.679 HG23 HG13 ' B' ' 13' ' ' ILE . 22.5 m -83.78 100.01 10.65 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.823 -0.806 . . . . 11.4 108.823 178.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.437 ' HB3' ' SD ' ' A' ' 88' ' ' MET . 6.0 m-20 -84.68 101.57 12.28 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.989 -0.55 . . . . 11.640000000000001 111.549 -178.373 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.411 HG21 ' HB2' ' A' ' 11' ' ' GLU . 2.5 m -103.87 121.1 42.37 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.98 -0.555 . . . . 11.220000000000001 109.791 178.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . 0.698 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 6.3 t-20 -75.87 125.26 28.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.939 0.4 . . . . 12.98 110.826 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 61.7 t -98.55 -49.47 11.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.728 -0.669 . . . . 15.109999999999999 109.929 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.55 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 52.1 mtpt . . . . . 0 C--O 1.252 1.194 0 CA-C-O 118.483 -0.77 . . . . 16.32 110.388 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 72.4 m . . . . . 0 N--CA 1.477 0.88 0 CA-C-O 120.871 0.367 . . . . 7.8399999999999999 110.23 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' GLN . . . . . 0.532 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 71.6 mm-40 -95.08 142.3 24.42 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.026 -0.534 . . . . 7.4900000000000002 110.997 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' B' ' 8' ' ' GLN . 10.8 Cg_exo -72.87 171.99 16.29 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 123.099 2.533 . . . . 6.4400000000000004 111.757 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.91 56.48 3.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.312 0.577 . . . . 5.9800000000000004 111.082 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.624 ' HA ' ' O ' ' B' ' 110' ' ' ASN . 0.0 OUTLIER -162.85 141.74 8.69 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.399 -0.963 . . . . 5.8499999999999996 108.399 179.722 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -152.47 165.73 34.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.334 0.588 . . . . 6.4900000000000002 112.274 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . 0.679 HG13 HG23 ' A' ' 109' ' ' THR . 9.1 mm -90.57 118.07 35.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 114.857 -1.065 . . . . 6.0199999999999996 110.329 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.636 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.7 OUTLIER -106.31 94.49 5.18 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.773 -0.649 . . . . 5.3700000000000001 110.293 179.639 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . 0.562 ' HG2' HG12 ' B' ' 107' ' ' ILE . 55.8 mtp180 -87.58 101.89 14.06 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.273 -0.64 . . . . 9.4600000000000009 109.273 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . 0.423 ' O ' ' HB2' ' B' ' 105' ' ' TYR . 35.0 p80 -132.21 162.07 31.85 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.132 -0.486 . . . . 8.3100000000000005 110.551 -179.064 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -83.17 177.91 8.34 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.517 -0.311 . . . . 11.19 110.291 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 26.6 pt -60.91 -20.88 22.8 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 113.24 0.83 . . . . 9.3699999999999992 113.24 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -83.69 -14.42 51.8 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.196 0.522 . . . . 11.92 110.601 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 104.14 -6.34 46.72 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.486 -0.864 . . . . 8.6799999999999997 111.901 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . 0.533 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 26.9 mm -70.03 117.21 12.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 110.021 -0.362 . . . . 11.16 110.021 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . 0.636 ' HE1' ' HB3' ' B' ' 14' ' ' SER . 97.0 m-85 -73.4 133.07 43.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.201 0.524 . . . . 8.5999999999999996 111.829 -179.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -103.89 -35.3 8.2 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.479 -0.782 . . . . 7.9100000000000001 110.018 178.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -148.04 129.55 14.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.794 -0.639 . . . . 8.5 110.246 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . 0.552 HG21 ' HB2' ' B' ' 40' ' ' LEU . 12.4 t -124.23 126.49 72.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.479 -0.563 . . . . 6.5 109.479 179.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -67.76 156.06 37.86 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.975 0.416 . . . . 7.1500000000000004 110.765 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -62.59 -19.21 63.51 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.842 -0.617 . . . . 9.4100000000000001 112.2 -178.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . 0.532 ' HG2' ' HB3' ' B' ' 8' ' ' GLN . 70.3 mtm180 -64.78 -16.73 63.42 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.839 0.311 . . . . 9.7599999999999998 111.839 -179.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 30.3 p -60.77 -32.62 71.93 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 120.872 0.368 . . . . 11.56 111.099 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . 0.612 HG12 HE22 ' B' ' 36' ' ' GLN . 18.1 t -64.51 -36.22 76.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 14.01 111.076 -179.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.49 -19.13 31.67 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.985 0.422 . . . . 12.9 110.811 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 20.1 m -84.52 -57.93 2.94 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.152 -0.476 . . . . 12.34 111.889 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' VAL . . . . . 0.467 HG13 ' HD2' ' B' ' 78' ' ' PHE . 6.2 m -122.24 -5.01 8.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 N-CA-C 112.373 0.509 . . . . 13.869999999999999 112.373 -178.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.86 -18.21 36.51 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.471 -0.871 . . . . 14.369999999999999 112.962 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -67.05 136.96 56.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.734 0.302 . . . . 15.56 110.919 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . 0.624 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 33.5 mm-40 -80.57 151.65 71.83 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 109.144 -0.687 . . . . 13.859999999999999 109.144 178.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.507 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 74.5 Cg_exo -50.61 -44.31 40.95 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.845 2.363 . . . . 15.210000000000001 112.864 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -65.11 -24.95 67.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.079 -0.509 . . . . 17.82 112.164 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.624 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 30.6 mt-10 -69.19 -25.82 64.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.805 0.336 . . . . 14.42 111.061 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.552 ' HB2' HG21 ' B' ' 25' ' ' VAL . 2.2 mm? -94.84 -21.27 18.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.226 -0.443 . . . . 14.550000000000001 110.873 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 52.5 mt -61.87 119.24 8.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.217 -0.447 . . . . 14.050000000000001 110.826 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 82.14 10.07 84.29 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.862 -0.685 . . . . 11.68 112.511 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.671 ' HA ' ' HE2' ' B' ' 43' ' ' LYS . 8.7 mmpt? -117.0 156.24 27.82 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 110.153 -0.314 . . . . 14.17 110.153 179.761 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' ASN . . . . . 0.715 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 13.5 m120 -93.29 135.93 34.04 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.153 -0.476 . . . . 10.74 109.91 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . 0.405 ' HB ' ' CZ ' ' B' ' 22' ' ' PHE . 15.4 tt -59.71 -26.27 34.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.285 0.564 . . . . 9.8800000000000008 110.847 178.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 9.8 p -71.17 -22.05 22.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.844 -0.616 . . . . 11.779999999999999 111.243 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . 0.715 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 44.2 mt-10 -70.63 -30.04 66.58 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.968 0.413 . . . . 11.890000000000001 110.668 -179.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -105.37 21.06 17.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.933 -0.576 . . . . 14.279999999999999 110.447 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 53.4 t -104.52 151.98 22.93 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 116.004 -0.544 . . . . 10.81 110.411 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' HIS . . . . . 0.423 ' CD2' ' HD2' ' B' ' 51' ' ' PRO . 10.4 t-80 -61.61 126.54 87.03 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.817 -0.629 . . . . 12.029999999999999 109.542 178.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' PRO . . . . . 0.423 ' HD2' ' CD2' ' B' ' 50' ' ' HIS . 76.0 Cg_exo -42.55 -50.32 5.85 Favored 'Trans proline' 0 CA--C 1.533 0.439 0 C-N-CA 123.62 2.88 . . . . 11.869999999999999 114.143 -179.354 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -75.98 2.98 11.19 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.649 0.611 . . . . 9.2799999999999994 112.649 -179.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -126.27 3.26 7.07 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.997 0.427 . . . . 7.5199999999999996 110.841 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -67.6 -37.55 82.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.822 -0.626 . . . . 6.5700000000000003 110.692 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 47.8 tp60 -65.86 -40.84 92.07 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.994 -0.743 . . . . 6.9900000000000002 108.994 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . 0.496 HD23 ' HB3' ' B' ' 76' ' ' PHE . 32.1 tp -57.2 -45.07 84.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.132 -0.94 . . . . 5.1399999999999997 110.713 178.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . 0.423 ' HA ' HD21 ' B' ' 57' ' ' LEU . 1.0 OUTLIER -61.02 -50.33 73.78 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.053 -0.521 . . . . 6.8200000000000003 110.739 179.645 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 55.3 ttt180 -59.82 -45.39 92.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.783 -0.644 . . . . 8.6899999999999995 110.925 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -62.0 -45.32 94.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.926 -0.579 . . . . 6.46 110.985 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 23.4 m -63.33 -37.85 88.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.219 -0.446 . . . . 5.5899999999999999 110.684 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 61' ' ' PHE . . . . . 0.482 ' O ' HG12 ' B' ' 64' ' ' VAL . 4.3 m-30 -65.08 -41.0 95.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.379 -0.373 . . . . 8.3300000000000001 110.411 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -63.9 -39.02 93.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.98 0.419 . . . . 7.1500000000000004 110.273 179.184 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.428 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 39.2 mt-30 -69.11 -40.48 78.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.976 -0.556 . . . . 9.5299999999999994 111.792 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.482 HG12 ' O ' ' B' ' 61' ' ' PHE . 4.0 p -67.19 -25.39 33.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-O 120.767 0.317 . . . . 8.2200000000000006 111.11 -179.278 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . 0.498 ' HA ' HG21 ' B' ' 94' ' ' THR . 51.7 t -69.21 -35.83 69.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 109.263 -0.643 . . . . 7.4299999999999997 109.263 178.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -70.48 -36.06 73.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.511 -0.768 . . . . 10.52 110.093 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' B' ' 63' ' ' GLN . 69.8 mt -65.56 -43.86 88.52 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.119 -0.697 . . . . 7.5300000000000002 109.119 178.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 65.9 tttt 47.29 90.57 0.02 OUTLIER 'General case' 0 C--O 1.235 0.298 0 CA-C-N 114.801 -1.09 . . . . 8.0099999999999998 112.837 178.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 108.6 1.59 32.67 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.552 -0.832 . . . . 5.8700000000000001 112.334 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -114.94 165.34 12.97 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.986 -0.376 . . . . 5.6299999999999999 109.986 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 6.6 t -108.14 127.13 64.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.067 0.461 . . . . 6.0599999999999996 111.118 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 42.0 tp -119.52 103.11 9.14 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.567 -0.742 . . . . 4.9299999999999997 109.062 178.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 73' ' ' SER . . . . . 0.589 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.3 p -86.64 112.59 21.76 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.046 -0.525 . . . . 6.79 111.228 -179.412 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 p -107.04 127.16 62.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.704 -0.68 . . . . 4.4199999999999999 109.927 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 28.7 ttt -100.54 110.33 22.49 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.08 0.467 . . . . 5.6699999999999999 110.815 -179.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.496 ' HB3' HD23 ' B' ' 56' ' ' LEU . 51.9 p90 -137.14 -173.16 3.38 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.729 -0.669 . . . . 3.75 109.368 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 77' ' ' ARG . . . . . 0.463 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 50.6 mtm180 -105.15 119.48 39.16 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.148 0.499 . . . . 7.3499999999999996 110.507 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . 0.467 ' HD2' HG13 ' B' ' 33' ' ' VAL . 16.8 t80 -102.49 148.84 25.03 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.2 -0.909 . . . . 5.79 110.339 -179.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 79' ' ' ARG . . . . . 0.643 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 3.6 ttp180 -90.06 124.27 34.64 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.205 -0.452 . . . . 11.529999999999999 110.185 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 80' ' ' SER . . . . . 0.516 ' HB3' HD21 ' B' ' 86' ' ' LEU . 95.0 p -91.52 -175.23 4.14 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.579 -0.526 . . . . 7.4699999999999998 109.579 178.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -65.16 -16.6 63.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.113 0.482 . . . . 12.67 110.479 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -89.23 -0.22 57.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.13 -0.486 . . . . 9.25 110.458 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 69.16 12.59 8.53 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.7 -0.682 . . . . 8.75 111.678 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -89.96 154.85 19.53 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.937 -0.394 . . . . 6.8700000000000001 109.937 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . 0.643 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 57.2 m95 -97.86 108.48 21.2 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.31 -0.405 . . . . 8.3800000000000008 111.371 -178.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . 0.516 HD21 ' HB3' ' B' ' 80' ' ' SER . 1.9 pp -109.31 147.52 32.54 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.071 -0.513 . . . . 7.25 110.176 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 87' ' ' TRP . . . . . 0.774 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 87.3 m95 -77.74 118.66 20.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.106 0.479 . . . . 9.3000000000000007 110.231 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 7.3 tpp -123.32 135.07 54.02 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.589 -0.732 . . . . 4.46 111.319 -178.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 37.5 ttp180 -96.17 89.55 5.18 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.633 -0.877 . . . . 7.3099999999999996 108.633 178.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 90' ' ' THR . . . . . 0.673 HG22 ' HB3' ' B' ' 108' ' ' CYS . 27.4 m -78.29 104.01 8.6 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.867 -0.606 . . . . 6.1799999999999997 111.111 -179.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 91' ' ' SER . . . . . 0.589 ' HA ' ' HA ' ' B' ' 73' ' ' SER . 1.8 m -85.63 91.0 8.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.875 -0.602 . . . . 6.4500000000000002 109.707 179.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 9.3 m -78.53 122.22 25.6 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.814 -0.63 . . . . 6.75 111.58 -178.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -122.09 121.74 37.64 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.095 -0.502 . . . . 6.4500000000000002 110.082 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 94' ' ' THR . . . . . 0.498 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.1 OUTLIER -82.23 110.25 17.25 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.449 -0.341 . . . . 9.8800000000000008 110.395 179.483 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.68 126.51 30.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.138 0.494 . . . . 8.9100000000000001 110.552 -179.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -96.26 119.05 34.03 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.555 -0.748 . . . . 10.99 110.446 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 97' ' ' ASN . . . . . 0.416 ' HB3' ' OE1' ' B' ' 102' ' ' GLU . 52.3 t30 -68.44 126.04 92.29 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.184 -0.673 . . . . 8.5099999999999998 109.184 178.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.48 4.5 2.46 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 123.095 2.53 . . . . 9.1600000000000001 114.084 -178.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -86.34 -70.56 0.6 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.843 0.354 . . . . 11.390000000000001 111.483 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -129.85 27.07 5.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.604 -0.271 . . . . 7.9000000000000004 111.039 -179.496 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 33.8 t70 60.36 49.29 7.09 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.585 0.707 . . . . 9.0800000000000001 110.215 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . 0.416 ' OE1' ' HB3' ' B' ' 97' ' ' ASN . 3.3 mp0 -97.8 153.92 17.97 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.876 -0.602 . . . . 7.71 110.123 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 46.0 mt -95.84 96.17 5.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 109.506 -0.553 . . . . 8.3800000000000008 109.506 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -68.02 -47.83 67.37 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.995 -0.548 . . . . 8.8100000000000005 110.819 -179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 105' ' ' TYR . . . . . 0.423 ' HB2' ' O ' ' B' ' 16' ' ' HIS . 8.8 p90 -167.93 178.39 5.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.406 -0.361 . . . . 7.8200000000000003 110.41 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 54.0 mt -120.44 115.96 48.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.89 -0.596 . . . . 7.2199999999999998 110.093 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . 0.562 HG12 ' HG2' ' B' ' 15' ' ' ARG . 19.7 mt -91.25 119.67 38.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 109.36 -0.608 . . . . 6.7199999999999998 109.36 179.463 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 108' ' ' CYS . . . . . 0.673 ' HB3' HG22 ' B' ' 90' ' ' THR . 71.4 m -111.43 117.88 34.28 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.909 0.385 . . . . 5.3099999999999996 111.812 -179.329 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 109' ' ' THR . . . . . 0.574 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 28.9 m -81.54 97.75 7.97 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.965 -1.124 . . . . 5.8700000000000001 107.965 177.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 110' ' ' ASN . . . . . 0.624 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.5 m-20 -79.39 102.1 8.5 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.708 -0.678 . . . . 6.9000000000000004 110.906 -178.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.04 113.25 26.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.261 -0.427 . . . . 8.9000000000000004 110.61 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -68.89 132.42 46.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.82 0.343 . . . . 11.84 110.558 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 113' ' ' VAL . . . . . 0.405 HG13 ' HG3' ' B' ' 114' ' ' LYS . 52.7 t -111.8 -46.18 5.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.987 -0.552 . . . . 12.4 110.239 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . 0.774 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 59.4 mtpt . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.568 -0.729 . . . . 12.68 109.927 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.521 ' HB2' ' CB ' ' A' ' 31' ' ' ALA . 49.8 mm-40 . . . . . 0 N--CA 1.454 -0.229 0 N-CA-C 110.032 -0.359 . . . . 15.44 110.032 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.31 170.99 18.91 Favored 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 122.545 2.163 . . . . 14.109999999999999 112.332 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' THR . . . . . 0.588 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.1 OUTLIER -84.15 50.83 1.93 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.031 -0.531 . . . . 11.369999999999999 111.13 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.498 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 3.6 tm-20 -153.61 137.88 16.59 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.591 -0.731 . . . . 10.59 109.036 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.863 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 26.9 p90 -153.22 142.96 21.99 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.091 0.472 . . . . 9.1999999999999993 110.874 179.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 50.3 mm -82.02 120.57 33.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.795 -0.639 . . . . 8.9399999999999995 111.083 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.755 ' HB3' ' HE1' ' A' ' 22' ' ' PHE . 1.6 m -103.2 94.24 5.42 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.907 -0.588 . . . . 6.1100000000000003 110.551 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.595 ' HD3' ' HB3' ' A' ' 24' ' ' PHE . 10.5 mtp180 -85.73 97.25 10.04 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.411 -0.588 . . . . 9.4600000000000009 109.411 179.502 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 30.9 p80 -127.66 154.28 45.47 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.682 -0.69 . . . . 10.369999999999999 110.251 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.6 p-10 -73.61 178.18 4.89 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.525 -0.307 . . . . 13.279999999999999 110.427 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.6 pt -56.63 -28.95 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 112.815 0.672 . . . . 13.970000000000001 112.815 -179.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -77.57 -17.2 58.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.892 0.377 . . . . 13.85 111.399 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 105.79 -3.22 38.9 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.596 -0.811 . . . . 9.6099999999999994 112.687 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.494 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 18.2 mm -71.62 117.15 14.51 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-O 120.764 0.316 . . . . 11.289999999999999 110.687 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.755 ' HE1' ' HB3' ' A' ' 14' ' ' SER . 98.6 m-85 -69.89 125.33 26.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.131 -0.486 . . . . 10.449999999999999 110.324 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 m -109.42 -21.55 12.45 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.358 0.599 . . . . 8.1300000000000008 109.96 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.595 ' HB3' ' HD3' ' A' ' 15' ' ' ARG . 23.7 t80 -151.86 116.43 5.09 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.882 -0.784 . . . . 7.4900000000000002 108.882 178.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.596 HG22 ' HB2' ' A' ' 40' ' ' LEU . 3.0 t -109.94 153.1 11.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-O 120.854 0.359 . . . . 6.4500000000000002 110.917 -178.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.863 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 5.0 t70 -72.0 172.54 9.84 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.91 -0.587 . . . . 7.3099999999999996 110.358 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -96.83 -25.01 15.62 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.319 0.58 . . . . 12.41 109.817 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 54.3 mtm180 -76.11 -4.34 40.99 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.485 -0.779 . . . . 12.19 112.371 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.9 p -59.25 -27.71 66.05 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 120.843 0.354 . . . . 13.5 111.544 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.43 ' O ' ' HA2' ' A' ' 34' ' ' GLY . 24.4 t -62.57 -34.94 67.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.98 -0.555 . . . . 16.559999999999999 110.923 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.521 ' CB ' ' HB2' ' A' ' 8' ' ' GLN . . . -93.48 -6.28 47.25 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.875 0.369 . . . . 15.07 111.011 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.8 m -90.99 -55.55 3.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.996 0.427 . . . . 15.26 110.304 179.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.552 HG13 ' HD2' ' A' ' 78' ' ' PHE . 3.7 m -123.56 -21.25 3.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.905 -0.589 . . . . 14.18 111.42 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.43 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 101.73 -17.49 54.71 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.391 -0.909 . . . . 13.85 112.147 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.411 ' H ' HG22 ' A' ' 33' ' ' VAL . 7.3 m-85 -71.41 137.2 48.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.806 0.336 . . . . 18.59 110.554 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 34.1 mm-40 -79.25 152.23 76.08 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.197 -0.668 . . . . 15.890000000000001 109.197 179.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.522 ' HB3' ' HB ' ' A' ' 25' ' ' VAL . 50.8 Cg_exo -53.89 -38.65 86.06 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.454 2.103 . . . . 12.26 112.168 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.433 ' HA ' HD12 ' A' ' 41' ' ' LEU . 26.2 mp0 -68.48 -16.61 63.95 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.833 -0.621 . . . . 13.68 111.624 -179.386 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.17 -23.48 35.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.991 0.424 . . . . 17.34 109.909 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.596 ' HB2' HG22 ' A' ' 25' ' ' VAL . 1.6 mm? -92.67 -32.24 14.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.874 -0.603 . . . . 13.56 110.288 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 86.8 mt -54.92 119.15 4.98 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.091 -0.504 . . . . 13.42 111.496 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.47 4.97 85.35 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.855 -0.688 . . . . 13.390000000000001 112.984 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.626 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 7.7 mmpt? -114.78 157.93 22.57 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 122.556 -0.379 . . . . 17.239999999999998 110.556 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.681 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 16.1 m120 -92.4 134.19 35.17 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.672 -0.492 . . . . 12.77 109.672 179.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.476 HD12 ' HZ ' ' A' ' 61' ' ' PHE . 11.3 tt -56.63 -30.39 31.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.991 0.424 . . . . 12.050000000000001 111.452 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.8 p -70.53 -17.94 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-N 116.247 -0.433 . . . . 13.390000000000001 111.753 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.681 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.2 mt-10 -72.48 -34.21 67.53 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.958 0.408 . . . . 16.530000000000001 110.431 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.442 ' HE1' ' HB3' ' A' ' 43' ' ' LYS . 68.3 m-85 -99.87 21.16 13.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.807 -0.633 . . . . 15.83 110.299 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 13.2 t -108.06 150.49 27.09 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.781 -0.645 . . . . 12.01 110.733 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.525 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 2.1 t-160 -56.09 128.17 71.23 Favored Pre-proline 0 C--N 1.333 -0.139 0 N-CA-C 109.019 -0.734 . . . . 15.130000000000001 109.019 178.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.43 ' HD2' ' CD2' ' A' ' 50' ' ' HIS . 5.7 Cg_endo -50.37 -40.91 52.82 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 122.777 2.318 . . . . 15.83 112.828 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -75.51 -14.55 60.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.484 -0.326 . . . . 16.690000000000001 111.36 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.525 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 34.5 m-20 -103.39 -6.63 21.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.605 -0.27 . . . . 13.16 111.203 -179.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -56.59 -42.56 78.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 16.170000000000002 111.344 -179.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 49.0 tp60 -64.68 -45.28 87.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.43 -0.35 . . . . 14.35 110.425 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.9 tp -59.55 -42.44 92.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.998 -0.546 . . . . 12.51 110.505 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.495 ' HA ' HD21 ' A' ' 57' ' ' LEU . 0.5 OUTLIER -63.16 -54.5 36.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.081 -0.509 . . . . 10.08 110.617 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 56.4 ttt180 -58.53 -41.02 84.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.08 -0.509 . . . . 11.710000000000001 110.919 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.38 -43.33 96.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.958 -0.564 . . . . 9.7100000000000009 110.579 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.6 m -70.19 -32.58 70.57 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.791 -0.64 . . . . 9.5199999999999996 111.148 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.535 ' O ' HG12 ' A' ' 64' ' ' VAL . 8.3 m-85 -62.09 -50.39 72.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.948 0.404 . . . . 12.109999999999999 110.488 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -67.86 -30.77 70.23 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.707 -0.479 . . . . 10.289999999999999 109.707 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -63.17 -45.32 92.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.633 -0.712 . . . . 10.619999999999999 110.915 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.535 HG12 ' O ' ' A' ' 61' ' ' PHE . 1.9 p -67.2 -24.1 31.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-O 120.813 0.34 . . . . 10.93 110.576 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.448 ' O ' ' HG3' ' A' ' 68' ' ' LYS . 69.3 t -72.43 -38.93 61.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 108.963 -0.754 . . . . 12.890000000000001 108.963 178.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 42.1 mtpt -73.46 -30.36 63.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.377 -0.829 . . . . 16.68 109.766 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 22.0 mt -68.36 -57.45 5.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.558 -0.747 . . . . 13.18 110.33 179.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' A' ' 65' ' ' VAL . 67.7 mttt 62.97 83.47 0.16 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.685 -0.689 . . . . 15.17 112.175 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.51 -47.72 1.0 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.579 -0.82 . . . . 10.01 113.127 178.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -71.6 136.22 47.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.944 0.402 . . . . 10.039999999999999 110.599 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.512 ' HB ' ' HZ ' ' B' ' 24' ' ' PHE . 4.1 p -80.44 123.94 37.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.611 -0.722 . . . . 8.5399999999999991 110.229 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 25.2 tp -107.14 109.56 21.42 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.067 0.461 . . . . 8.1300000000000008 110.569 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.436 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 1.3 m -89.56 109.04 20.02 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.796 -0.638 . . . . 7.8899999999999997 110.923 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 p -103.8 129.71 55.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.403 -0.362 . . . . 8.1799999999999997 110.082 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' MET . . . . . 0.415 ' HE1' ' HB3' ' A' ' 87' ' ' TRP . 26.2 ttt -104.28 115.08 29.76 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.096 0.474 . . . . 9.6999999999999993 110.433 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.563 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 31.6 p90 -145.86 178.58 8.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.797 -0.638 . . . . 10.27 109.975 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.77 ' HB3' ' HB3' ' A' ' 85' ' ' TRP . 9.0 mtt180 -98.14 116.51 30.51 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.836 0.35 . . . . 13.859999999999999 110.472 179.256 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.563 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 19.4 t80 -100.95 147.29 26.33 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.107 -0.497 . . . . 9.7300000000000004 109.897 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.427 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 37.9 ttp180 -81.91 132.59 35.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.858 0.361 . . . . 11.300000000000001 111.001 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.451 ' HA ' ' HB ' ' A' ' 33' ' ' VAL . 54.6 p -95.94 -176.69 3.78 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.078 -0.51 . . . . 11.039999999999999 110.108 179.142 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.5 tptt -69.64 -18.74 63.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.344 0.592 . . . . 13.18 109.614 178.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 -91.38 5.33 49.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.634 -0.712 . . . . 14.890000000000001 109.685 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 65.51 23.71 11.83 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.115 -0.948 . . . . 12.92 111.659 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.407 ' HG2' ' OG ' ' A' ' 80' ' ' SER . 2.2 pt-20 -98.71 164.89 12.05 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.123 -0.695 . . . . 10.94 109.123 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.77 ' HB3' ' HB3' ' A' ' 77' ' ' ARG . 55.2 m95 -109.61 112.63 24.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.133 0.492 . . . . 11.77 111.29 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.5 HD22 HG12 ' A' ' 33' ' ' VAL . 1.3 pp -108.66 150.31 27.72 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.77 -0.65 . . . . 11.57 110.17 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.415 ' HB3' ' HE1' ' A' ' 75' ' ' MET . 98.8 m95 -76.34 116.35 16.94 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.019 0.437 . . . . 10.73 110.487 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 18.2 tpp -116.86 129.05 55.83 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.75 -0.659 . . . . 9.7400000000000002 110.718 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.3 ttp180 -100.66 77.4 1.89 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.471 -0.937 . . . . 11.16 108.471 178.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.403 HG22 ' HB3' ' A' ' 108' ' ' CYS . 61.2 m -69.54 108.37 3.78 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.353 -0.84 . . . . 9.5899999999999999 113.033 -177.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.461 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 1.5 m -86.78 95.1 9.72 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.947 -0.76 . . . . 8.8800000000000008 108.947 177.675 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.3 m -83.63 130.71 34.98 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.005 0.372 . . . . 8.9399999999999995 112.005 -178.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -124.58 129.07 49.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.714 -0.675 . . . . 12.1 110.057 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.38 115.23 15.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.29 -0.414 . . . . 10.16 111.001 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -89.99 106.18 18.3 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.968 0.413 . . . . 12.6 110.314 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.571 ' HG2' HG12 ' A' ' 103' ' ' ILE . 16.6 mt-30 -114.8 156.93 23.98 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.776 -0.647 . . . . 14.6 110.689 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.409 ' HB2' ' OE2' ' A' ' 102' ' ' GLU . 92.1 m-20 -95.2 149.09 35.7 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 109.096 -0.705 . . . . 13.83 109.096 178.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -83.15 18.42 1.5 Allowed 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 122.581 2.187 . . . . 15.34 112.58 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -97.71 -66.57 0.89 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.369 -0.378 . . . . 16.890000000000001 110.903 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.4 m -126.01 20.28 7.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.459 -0.337 . . . . 15.140000000000001 110.522 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.7 t70 60.41 33.51 20.7 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.715 -0.675 . . . . 14.94 110.94 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.409 ' OE2' ' HB2' ' A' ' 97' ' ' ASN . 0.5 OUTLIER -78.05 136.9 38.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.936 -0.575 . . . . 12.949999999999999 110.154 -179.826 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.571 HG12 ' HG2' ' A' ' 96' ' ' GLN . 45.8 mt -94.0 114.19 30.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.84 -0.43 . . . . 11.44 109.84 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -77.32 -53.56 7.55 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.828 0.347 . . . . 11.65 110.78 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 15.4 p90 -158.17 -178.27 7.17 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.271 -0.422 . . . . 10.35 110.525 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 24.4 mt -113.34 116.16 51.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.96 -0.564 . . . . 10.470000000000001 110.072 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 59.3 mt -83.21 100.1 6.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.14 -0.482 . . . . 9.3200000000000003 109.875 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.403 ' HB3' HG22 ' A' ' 90' ' ' THR . 51.8 m -94.68 114.71 26.67 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.243 -0.435 . . . . 10.15 111.33 -179.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.461 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 4.0 m -87.51 93.02 9.29 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.912 -0.773 . . . . 11.4 108.912 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.498 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 6.2 m-20 -78.3 99.23 6.22 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.849 -0.614 . . . . 11.640000000000001 112.019 -178.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.771 HG21 HH12 ' B' ' 28' ' ' ARG . 0.7 OUTLIER -107.22 117.74 34.87 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.883 -0.414 . . . . 11.220000000000001 109.883 178.306 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . 0.588 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 8.5 t-20 -76.53 130.13 37.47 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.016 0.436 . . . . 12.98 110.975 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 28.9 t -104.77 -54.79 6.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 115.622 -0.717 . . . . 15.109999999999999 109.576 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 46.7 mtpt . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.141 -0.933 . . . . 16.32 110.006 -179.656 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 77.2 m . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 110.173 -0.306 . . . . 7.8399999999999999 110.173 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -120.72 151.5 54.51 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 116.565 -0.289 . . . . 7.4900000000000002 110.224 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -66.06 161.13 41.24 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.751 2.3 . . . . 6.4400000000000004 112.664 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' THR . . . . . 0.458 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.3 OUTLIER -82.09 59.81 4.59 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.834 -0.621 . . . . 5.9800000000000004 111.364 -179.499 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.527 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -156.38 153.28 28.69 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.811 -0.811 . . . . 5.8499999999999996 108.811 179.184 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -158.83 158.54 33.68 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.137 0.494 . . . . 6.4900000000000002 111.358 179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . 0.544 ' HB ' ' HB2' ' B' ' 26' ' ' ASP . 21.5 mm -93.35 117.05 35.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.541 -0.754 . . . . 6.0199999999999996 110.09 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.655 ' HB3' ' HE2' ' B' ' 22' ' ' PHE . 0.6 OUTLIER -107.32 96.31 6.32 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.094 -0.503 . . . . 5.3700000000000001 111.303 -179.084 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . 0.652 ' HD3' ' HB3' ' B' ' 24' ' ' PHE . 23.5 mtp85 -90.66 107.7 19.34 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.908 -0.775 . . . . 9.4600000000000009 108.908 179.046 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . 0.439 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 31.3 p80 -136.98 165.55 25.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.63 -0.259 . . . . 8.3100000000000005 111.45 -178.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -77.94 177.33 8.34 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 116.038 -0.528 . . . . 11.19 110.245 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 22.8 pt -58.11 -30.48 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 N-CA-C 112.917 0.71 . . . . 9.3699999999999992 112.917 -178.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -78.63 -16.85 56.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.08 0.467 . . . . 11.92 111.495 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 108.16 -1.12 33.25 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.432 -0.89 . . . . 8.6799999999999997 112.359 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . 0.504 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 33.1 mm -69.56 111.87 3.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 N-CA-C 109.805 -0.443 . . . . 11.16 109.805 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . 0.655 ' HE2' ' HB3' ' B' ' 14' ' ' SER . 57.1 m-85 -63.57 126.72 28.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.248 -0.433 . . . . 8.5999999999999996 110.972 -179.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 1.4 m -100.64 -33.37 10.32 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.957 -0.565 . . . . 7.9100000000000001 110.237 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . 0.652 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 32.3 t80 -156.62 127.33 6.72 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.693 -0.685 . . . . 8.5 109.437 179.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 15.0 t -115.02 138.3 45.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.434 -0.348 . . . . 6.5 110.672 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . 0.544 ' HB2' ' HB ' ' B' ' 13' ' ' ILE . 9.6 t70 -75.02 141.65 43.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.058 -0.519 . . . . 7.1500000000000004 109.698 179.173 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 18.4 m170 -70.4 87.54 0.63 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.05 0.453 . . . . 9.4100000000000001 110.185 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . 0.771 HH12 HG21 ' A' ' 111' ' ' THR . 12.5 mtm180 -169.53 -21.57 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.022 -0.99 . . . . 9.7599999999999998 110.408 -179.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 24.3 p -55.86 -30.53 61.65 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.601 0.593 . . . . 11.56 112.601 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 t -68.36 -21.84 26.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.138 0.494 . . . . 14.01 110.782 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -96.25 -19.49 19.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.151 -0.477 . . . . 12.9 110.039 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 2.5 m -85.61 -60.02 2.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.978 -0.555 . . . . 12.34 111.303 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' VAL . . . . . 0.522 HG13 ' HD2' ' B' ' 78' ' ' PHE . 3.5 m -116.58 -14.52 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.808 0.337 . . . . 13.869999999999999 111.586 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.82 -2.96 77.27 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.503 -0.856 . . . . 14.369999999999999 112.817 179.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -82.32 137.8 34.7 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.716 0.293 . . . . 15.56 110.62 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . 0.81 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 77.5 mm-40 -73.21 146.75 87.27 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 116.092 -0.504 . . . . 13.859999999999999 109.769 179.114 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.555 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 51.1 Cg_exo -53.89 -39.76 83.28 Favored 'Trans proline' 0 CA--C 1.529 0.27 0 C-N-CA 122.38 2.053 . . . . 15.210000000000001 112.125 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -69.34 -14.52 62.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.849 -0.614 . . . . 17.82 111.864 -179.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.81 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 29.3 mt-10 -82.72 -21.07 34.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.94 0.4 . . . . 14.42 110.368 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.447 ' HB3' ' CG ' ' B' ' 22' ' ' PHE . 1.2 mm? -94.57 -28.5 15.37 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.802 -0.635 . . . . 14.550000000000001 110.016 179.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 87.1 mt -62.71 119.21 8.84 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.986 -0.552 . . . . 14.050000000000001 110.692 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 90.24 -2.98 81.97 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.911 -0.661 . . . . 11.68 112.097 -179.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.504 ' O ' ' HA ' ' B' ' 21' ' ' ILE . 1.5 mmpt? -109.14 161.66 15.0 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.681 0.277 . . . . 14.17 110.29 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' ASN . . . . . 0.767 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 15.4 m120 -96.63 135.24 38.81 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.484 -0.562 . . . . 10.74 109.484 179.626 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.1 tt -60.68 -22.65 26.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.224 0.535 . . . . 9.8800000000000008 110.75 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 9.9 p -74.59 -18.19 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 116.052 -0.522 . . . . 11.779999999999999 111.196 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . 0.767 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 36.5 mt-10 -73.85 -38.25 64.55 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.959 0.409 . . . . 11.890000000000001 110.877 -179.526 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' PHE . . . . . 0.489 ' HB2' ' CZ ' ' B' ' 78' ' ' PHE . 25.4 m-85 -96.34 18.28 14.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.018 -0.537 . . . . 14.279999999999999 110.575 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 51.9 t -103.11 149.56 24.49 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.071 -0.513 . . . . 10.81 110.647 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' HIS . . . . . 0.656 ' HB3' ' HB2' ' B' ' 53' ' ' ASP . 9.3 t-160 -57.19 127.63 76.7 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.663 -0.699 . . . . 12.029999999999999 109.17 178.46 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_exo -45.06 -50.8 8.37 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.083 2.522 . . . . 11.869999999999999 113.438 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 13.5 mp0 -75.08 4.15 7.26 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.447 0.536 . . . . 9.2799999999999994 112.447 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . 0.656 ' HB2' ' HB3' ' B' ' 50' ' ' HIS . 6.0 m-20 -122.46 -0.22 9.3 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.108 0.48 . . . . 7.5199999999999996 110.341 179.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -66.69 -38.37 86.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.802 -0.635 . . . . 6.5700000000000003 110.794 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 48.1 tp60 -65.65 -45.21 83.84 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.682 -0.488 . . . . 6.9900000000000002 109.682 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 40.7 tp -58.77 -42.49 89.07 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.482 -0.781 . . . . 5.1399999999999997 110.573 179.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . 0.41 ' HA ' HD21 ' B' ' 57' ' ' LEU . 1.1 mt -63.02 -54.55 36.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.032 -0.531 . . . . 6.8200000000000003 110.777 179.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 42.2 ttt180 -58.36 -43.63 88.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 8.6899999999999995 111.059 -179.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -60.14 -46.04 91.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.042 -0.526 . . . . 6.46 110.645 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 42.5 m -63.92 -39.02 93.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.069 -0.514 . . . . 5.5899999999999999 110.726 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 61' ' ' PHE . . . . . 0.451 ' O ' HG12 ' B' ' 64' ' ' VAL . 9.7 m-85 -62.95 -44.13 96.91 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.829 0.347 . . . . 8.3300000000000001 110.287 179.392 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -66.93 -35.0 79.0 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.309 -0.405 . . . . 7.1500000000000004 110.375 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.402 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 27.2 mt-30 -69.92 -40.76 75.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.109 -0.496 . . . . 9.5299999999999994 111.593 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.451 HG12 ' O ' ' B' ' 61' ' ' PHE . 9.8 p -70.02 -25.96 28.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 120.917 0.389 . . . . 8.2200000000000006 110.832 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . 0.597 ' HA ' HG21 ' B' ' 94' ' ' THR . 24.6 t -68.44 -32.81 56.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.389 0.614 . . . . 7.4299999999999997 109.407 178.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -78.53 -11.49 59.96 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.475 -0.784 . . . . 10.52 110.85 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.596 ' HB3' ' HB2' ' B' ' 70' ' ' GLN . 96.8 mt -82.7 -55.7 4.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.128 -0.487 . . . . 7.5300000000000002 109.996 179.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 79.8 mttt 66.18 111.22 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.492 -0.777 . . . . 8.0099999999999998 111.702 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . 0.419 ' HA3' ' OE1' ' B' ' 96' ' ' GLN . . . 75.98 19.54 78.63 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.626 -0.797 . . . . 5.8700000000000001 112.291 179.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . 0.596 ' HB2' ' HB3' ' B' ' 67' ' ' LEU . 26.6 mm-40 -128.45 163.66 24.42 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.665 -0.495 . . . . 5.6299999999999999 109.665 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 71' ' ' VAL . . . . . 0.431 ' HB ' ' HD1' ' B' ' 93' ' ' PHE . 9.8 p -116.72 131.16 70.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 121.27 0.557 . . . . 6.0599999999999996 111.068 -179.232 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 21.0 tp -118.46 116.02 25.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.932 -0.577 . . . . 4.9299999999999997 109.616 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 73' ' ' SER . . . . . 0.421 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.8 m -92.31 114.77 27.41 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.836 -0.62 . . . . 6.79 111.351 -179.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . 0.436 HG12 ' HB ' ' B' ' 90' ' ' THR . 2.5 p -108.04 128.8 63.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.931 -0.577 . . . . 4.4199999999999999 110.0 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 27.9 ttt -102.16 108.08 19.37 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.032 0.444 . . . . 5.6699999999999999 110.525 -179.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.425 ' HE2' ' HD1' ' B' ' 78' ' ' PHE . 26.8 p90 -138.49 -171.45 3.06 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.895 -0.593 . . . . 3.75 109.893 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 77' ' ' ARG . . . . . 0.579 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 59.0 mtm180 -114.66 119.29 36.23 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.15 0.5 . . . . 7.3499999999999996 110.53 179.27 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . 0.522 ' HD2' HG13 ' B' ' 33' ' ' VAL . 19.7 t80 -99.53 144.85 28.15 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.451 -0.795 . . . . 5.79 110.504 -179.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 79' ' ' ARG . . . . . . . . . . . . . 39.7 ttp180 -82.62 120.02 25.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.365 -0.38 . . . . 11.529999999999999 110.208 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 80' ' ' SER . . . . . 0.466 ' OG ' ' HG2' ' B' ' 84' ' ' GLU . 99.8 p -87.71 -175.21 5.09 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.841 0.353 . . . . 7.4699999999999998 110.747 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 39.8 tptt -66.37 -16.72 64.29 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.023 -0.535 . . . . 12.67 110.418 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 23.7 m-20 -92.84 4.18 54.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.02 -0.536 . . . . 9.25 109.837 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 68.86 16.36 8.85 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.323 -0.853 . . . . 8.75 112.029 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . 0.466 ' HG2' ' OG ' ' B' ' 80' ' ' SER . 13.4 pt-20 -97.01 148.08 23.35 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.683 -0.488 . . . . 6.8700000000000001 109.683 179.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . 0.579 ' HB3' ' HB3' ' B' ' 77' ' ' ARG . 2.7 m95 -95.05 103.63 15.49 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.089 -0.337 . . . . 8.3800000000000008 110.089 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . 0.495 HD21 HG12 ' B' ' 33' ' ' VAL . 1.6 pp -97.45 146.43 25.22 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.515 -0.311 . . . . 7.25 110.645 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 87' ' ' TRP . . . . . 0.586 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 87.0 m95 -72.8 116.97 13.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.392 -0.367 . . . . 9.3000000000000007 110.111 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 88' ' ' MET . . . . . 0.413 ' SD ' ' HB3' ' B' ' 110' ' ' ASN . 3.9 ttp -131.3 134.57 46.49 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.01 -0.541 . . . . 4.46 110.657 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 37.5 ttp180 -96.98 105.28 17.4 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.72 -0.673 . . . . 7.3099999999999996 109.353 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 90' ' ' THR . . . . . 0.777 HG22 ' HB3' ' B' ' 108' ' ' CYS . 19.7 m -88.32 106.89 18.53 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.895 -0.593 . . . . 6.1799999999999997 111.014 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 91' ' ' SER . . . . . 0.469 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 0.8 OUTLIER -87.9 88.58 7.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.827 -0.624 . . . . 6.4500000000000002 109.321 179.129 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 9.3 m -80.49 122.65 27.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.082 -0.508 . . . . 6.75 111.968 -178.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . 0.431 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 77.6 t80 -115.47 125.46 53.11 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.261 -0.427 . . . . 6.4500000000000002 109.949 178.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 94' ' ' THR . . . . . 0.597 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.4 OUTLIER -88.33 104.3 16.63 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.757 0.313 . . . . 9.8800000000000008 110.735 179.763 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -71.7 132.45 44.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.307 -0.406 . . . . 8.9100000000000001 110.541 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 96' ' ' GLN . . . . . 0.419 ' OE1' ' HA3' ' B' ' 69' ' ' GLY . 50.9 mt-30 -99.0 137.65 37.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.851 -0.613 . . . . 10.99 111.851 -178.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 97' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -89.85 124.13 64.51 Favored Pre-proline 0 C--N 1.323 -0.568 0 N-CA-C 108.329 -0.989 . . . . 8.5099999999999998 108.329 177.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.54 51.19 1.11 Allowed 'Trans proline' 0 CA--C 1.534 0.479 0 C-N-CA 123.137 2.558 . . . . 9.1600000000000001 113.703 -179.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -138.02 -77.82 0.37 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.547 -0.297 . . . . 11.390000000000001 110.425 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 14.7 m -113.24 20.11 16.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.128 0.49 . . . . 7.9000000000000004 109.908 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.6 t0 61.66 35.03 17.27 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.087 -0.961 . . . . 9.0800000000000001 111.341 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -82.07 164.93 21.04 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.967 -0.561 . . . . 7.71 109.767 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 69.4 mt -103.33 118.77 50.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.486 -0.324 . . . . 8.3800000000000008 110.284 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -66.09 -64.26 0.9 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.063 0.458 . . . . 8.8100000000000005 109.788 179.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 6.6 p90 -157.92 172.47 18.4 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.392 -0.822 . . . . 7.8200000000000003 109.666 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 57.8 mt -102.96 113.16 38.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.403 -0.362 . . . . 7.2199999999999998 110.081 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 13.2 mt -88.91 105.52 15.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 109.332 -0.618 . . . . 6.7199999999999998 109.332 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 108' ' ' CYS . . . . . 0.777 ' HB3' HG22 ' B' ' 90' ' ' THR . 97.1 m -99.25 106.1 18.19 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.375 0.509 . . . . 5.3099999999999996 112.375 -178.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 109' ' ' THR . . . . . 0.469 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 2.9 m -79.89 84.26 5.69 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.647 -0.872 . . . . 5.8700000000000001 108.647 177.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 110' ' ' ASN . . . . . 0.413 ' HB3' ' SD ' ' B' ' 88' ' ' MET . 7.3 m-20 -71.16 121.71 18.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.552 -0.749 . . . . 6.9000000000000004 111.752 -178.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.13 116.63 22.36 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.213 -0.448 . . . . 8.9000000000000004 110.111 179.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 112' ' ' ASN . . . . . 0.458 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 8.1 t-20 -68.44 135.3 51.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.116 0.484 . . . . 11.84 110.875 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 2.0 t -109.12 -50.12 7.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.683 -0.69 . . . . 12.4 109.9 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . 0.586 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 92.0 mttt . . . . . 0 C--O 1.246 0.905 0 CA-C-O 118.61 -0.71 . . . . 12.68 109.829 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 . . . . . 0 N--CA 1.455 -0.176 0 N-CA-C 109.794 -0.447 . . . . 15.44 109.794 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -69.57 159.9 51.79 Favored 'Trans proline' 0 C--O 1.233 0.271 0 C-N-CA 122.805 2.337 . . . . 14.109999999999999 112.664 -179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' THR . . . . . 0.491 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.0 OUTLIER -86.87 55.77 3.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.853 -0.612 . . . . 11.369999999999999 110.233 179.79 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.456 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 8.8 tt0 -157.55 144.06 17.9 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.492 -0.776 . . . . 10.59 109.728 -178.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.792 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 27.2 p90 -150.63 143.58 24.69 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.066 0.46 . . . . 9.1999999999999993 111.114 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.455 HG21 HG21 ' A' ' 107' ' ' ILE . 50.5 mm -80.0 115.23 22.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.902 -0.59 . . . . 8.9399999999999995 110.444 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.906 ' HB3' ' HE2' ' A' ' 22' ' ' PHE . 1.6 m -100.21 99.52 10.22 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.986 -0.552 . . . . 6.1100000000000003 110.94 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.648 ' HD3' ' HB3' ' A' ' 24' ' ' PHE . 15.1 mtp180 -91.72 106.7 18.67 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.419 -0.586 . . . . 9.4600000000000009 109.419 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.8 p80 -133.73 159.98 38.94 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.507 -0.315 . . . . 10.369999999999999 110.887 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -75.82 179.32 5.55 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.336 -0.393 . . . . 13.279999999999999 110.618 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.1 pt -53.93 -36.45 30.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 112.528 0.566 . . . . 13.970000000000001 112.528 -179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -68.82 -46.47 68.54 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.989 0.424 . . . . 13.85 111.039 -179.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 137.22 -8.46 3.79 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.609 -0.805 . . . . 9.6099999999999994 111.724 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.459 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 33.5 mm -64.99 116.1 3.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 109.908 -0.405 . . . . 11.289999999999999 109.908 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.906 ' HE2' ' HB3' ' A' ' 14' ' ' SER . 89.7 m-85 -66.82 122.33 17.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.156 -0.474 . . . . 10.449999999999999 110.885 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.82 -32.59 13.89 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.678 -0.692 . . . . 8.1300000000000008 109.735 179.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.648 ' HB3' ' HD3' ' A' ' 15' ' ' ARG . 55.1 t80 -147.43 133.63 19.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.517 -0.765 . . . . 7.4900000000000002 109.337 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.405 HG21 ' HB2' ' A' ' 40' ' ' LEU . 22.1 t -119.41 147.19 23.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.253 0.549 . . . . 6.4500000000000002 111.606 -178.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.792 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 5.4 t70 -68.8 -179.55 1.47 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 114.911 -1.04 . . . . 7.3099999999999996 110.499 179.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 25.8 m170 -108.34 -20.29 13.18 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.105 0.479 . . . . 12.41 110.226 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 63.9 mtm180 -76.94 -6.68 53.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.83 -0.623 . . . . 12.19 111.272 -179.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 25.1 p -57.65 -31.23 66.09 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.344 -0.389 . . . . 13.5 111.376 -179.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.487 ' O ' ' HA2' ' A' ' 34' ' ' GLY . 13.4 t -62.84 -31.43 52.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.943 -0.571 . . . . 16.559999999999999 111.057 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -92.77 -17.54 24.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.966 0.412 . . . . 15.07 110.781 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.485 ' HA ' HG21 ' A' ' 10' ' ' THR . 5.3 m -82.11 -67.33 0.79 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.067 -0.515 . . . . 15.26 110.927 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 2.4 m -113.11 -8.79 12.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.381 -0.372 . . . . 14.18 111.51 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.487 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 85.56 -2.64 87.9 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.519 -0.848 . . . . 13.85 112.234 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -78.16 136.7 37.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.858 0.361 . . . . 18.59 110.771 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.552 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 26.0 mm-40 -77.98 149.31 76.65 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 108.708 -0.849 . . . . 15.890000000000001 108.708 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.42 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 76.4 Cg_exo -51.3 -38.19 61.63 Favored 'Trans proline' 0 CA--C 1.53 0.287 0 C-N-CA 122.555 2.17 . . . . 12.26 112.853 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.518 ' HA ' HD12 ' A' ' 41' ' ' LEU . 19.9 mp0 -71.67 -14.84 62.16 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.155 -0.475 . . . . 13.68 111.729 -179.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.552 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 31.5 mt-10 -81.18 -22.8 38.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.788 0.328 . . . . 17.34 110.295 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.405 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.9 mm? -94.68 -34.68 12.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.978 -0.555 . . . . 13.56 109.989 179.519 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 38' ' ' GLN . 82.5 mt -57.88 120.89 9.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.808 -0.633 . . . . 13.42 111.068 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.15 3.3 87.52 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.66 -0.781 . . . . 13.390000000000001 112.471 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.742 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 8.7 mmpt? -112.64 163.25 14.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.86 0.362 . . . . 17.239999999999998 110.3 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.657 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 7.8 m120 -96.41 137.53 35.34 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.997 -0.547 . . . . 12.77 110.008 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 19.7 tt -63.47 -23.37 33.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.113 0.482 . . . . 12.050000000000001 111.075 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.423 HG13 ' HB3' ' A' ' 44' ' ' ASN . 8.3 p -78.73 -16.49 13.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.275 -0.42 . . . . 13.390000000000001 111.445 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.657 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.2 mt-10 -69.36 -39.83 77.86 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.019 0.437 . . . . 16.530000000000001 110.817 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.4 ' HB2' ' CZ ' ' A' ' 78' ' ' PHE . 22.8 m-85 -97.91 23.89 7.54 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.015 -0.539 . . . . 15.83 110.402 -179.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.527 ' HG ' HD13 ' A' ' 57' ' ' LEU . 52.4 t -104.94 147.18 28.06 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 115.847 -0.615 . . . . 12.01 110.066 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.446 ' CD2' ' HD2' ' A' ' 51' ' ' PRO . 8.4 t-160 -58.98 127.38 83.48 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.128 -0.487 . . . . 15.130000000000001 109.734 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.446 ' HD2' ' CD2' ' A' ' 50' ' ' HIS . 88.9 Cg_exo -43.6 -50.73 6.74 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.308 2.672 . . . . 15.83 113.77 -179.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.49 -3.27 17.02 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.48 0.548 . . . . 16.690000000000001 112.48 -179.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -120.58 1.83 10.64 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 122.195 -0.315 . . . . 13.16 110.901 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -62.85 -47.45 83.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.175 -0.466 . . . . 16.170000000000002 111.406 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 44.8 tp60 -69.38 -34.71 74.94 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.57 -0.53 . . . . 14.35 109.57 178.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.7 tp -57.76 -40.87 80.78 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.34 0.59 . . . . 12.51 109.81 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.527 HD13 ' HG ' ' A' ' 49' ' ' CYS . 0.7 OUTLIER -66.81 -46.06 76.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.468 -0.787 . . . . 10.08 110.02 179.052 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 69.1 ttt180 -61.45 -43.67 98.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.143 -0.481 . . . . 11.710000000000001 110.775 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -58.91 -39.13 80.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.214 0.53 . . . . 9.7100000000000009 110.288 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.3 m -72.36 -33.9 67.61 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.679 -0.691 . . . . 9.5199999999999996 110.618 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.492 ' O ' HG13 ' A' ' 64' ' ' VAL . 4.6 m-85 -64.29 -45.99 85.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.887 0.375 . . . . 12.109999999999999 110.207 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -64.15 -33.06 74.92 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.991 0.424 . . . . 10.289999999999999 109.928 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -64.77 -48.87 72.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.777 -0.647 . . . . 10.619999999999999 110.724 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.584 ' HA ' HD12 ' A' ' 67' ' ' LEU . 4.2 p -65.17 -26.93 40.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 CA-C-N 116.646 -0.252 . . . . 10.93 111.268 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 61' ' ' PHE . 55.5 t -69.31 -37.28 75.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 121.299 0.571 . . . . 12.890000000000001 109.694 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 27.4 mtpt -78.99 -33.0 45.42 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.794 -0.639 . . . . 16.68 109.946 179.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.701 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 66.6 mt -60.0 -56.56 20.14 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.914 -0.584 . . . . 13.18 110.639 179.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 65.3 mttt 62.21 103.65 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 O-C-N 123.861 0.726 . . . . 15.17 112.163 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 83.69 19.81 61.03 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.369 -0.919 . . . . 10.01 112.132 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.701 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 7.9 tp-100 -128.84 139.35 52.21 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.167 -0.679 . . . . 10.039999999999999 109.167 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.481 ' CG2' ' HB3' ' A' ' 91' ' ' SER . 2.6 p -97.25 117.4 41.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.129 0.49 . . . . 8.5399999999999991 110.383 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 46.4 tp -106.33 117.08 33.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.907 -0.588 . . . . 8.1300000000000008 110.488 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.525 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 9.1 m -93.79 106.93 18.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.054 -0.521 . . . . 7.8899999999999997 110.97 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.2 p -99.67 132.02 45.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.186 -0.461 . . . . 8.1799999999999997 110.19 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 23.6 ttt -102.86 119.45 38.86 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.344 -0.389 . . . . 9.6999999999999993 110.344 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.504 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 46.8 p90 -150.32 -174.67 4.81 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.787 -0.642 . . . . 10.27 109.385 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.454 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 36.1 mtm180 -107.38 121.79 45.29 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.153 0.501 . . . . 13.859999999999999 110.954 179.412 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.504 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 13.0 t80 -104.12 148.46 26.24 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.352 -0.84 . . . . 9.7300000000000004 109.728 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.607 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 1.1 ttt180 -88.09 123.67 33.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.9 0.381 . . . . 11.300000000000001 110.735 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.555 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 85.2 p -85.38 -176.5 6.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.018 -0.537 . . . . 11.039999999999999 109.908 179.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.419 ' HD2' ' HA ' ' A' ' 81' ' ' LYS . 35.4 tptt -67.97 -17.3 64.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.321 0.581 . . . . 13.18 109.755 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -88.34 2.92 51.51 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.581 -0.736 . . . . 14.890000000000001 110.247 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 67.23 19.32 10.3 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 115.596 -0.729 . . . . 12.92 110.842 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.555 ' HG2' ' OG ' ' A' ' 80' ' ' SER . 5.8 pt-20 -94.59 154.37 17.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.087 -0.506 . . . . 10.94 109.902 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.607 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 44.7 m95 -101.36 105.77 16.86 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.422 -0.354 . . . . 11.77 110.61 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.454 ' O ' ' HA ' ' A' ' 77' ' ' ARG . 1.5 pp -107.92 151.63 25.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.23 -0.441 . . . . 11.57 110.385 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.578 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 89.8 m95 -78.43 120.88 23.79 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.073 0.463 . . . . 10.73 110.7 -179.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 5.9 tpp -122.96 140.2 53.27 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.748 -0.66 . . . . 9.7400000000000002 111.071 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.437 ' CZ ' ' HG ' ' A' ' 91' ' ' SER . 1.6 ttp180 -102.44 94.37 5.65 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.343 -0.984 . . . . 11.16 108.343 177.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.571 HG22 ' HB3' ' A' ' 108' ' ' CYS . 45.4 m -86.92 105.21 16.93 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.893 -0.594 . . . . 9.5899999999999999 112.048 -178.591 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.814 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 70.8 m -88.29 92.34 9.13 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.981 -0.554 . . . . 8.8800000000000008 109.629 178.341 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.5 m -81.08 124.03 28.87 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.809 -0.632 . . . . 8.9399999999999995 111.03 -178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -121.57 120.16 34.02 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.815 -0.63 . . . . 12.1 109.488 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.09 115.11 10.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.875 0.369 . . . . 10.16 111.199 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -92.34 109.47 20.85 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.236 -0.438 . . . . 12.6 109.97 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -104.68 152.09 22.92 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.818 -0.628 . . . . 14.6 111.316 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -91.75 137.95 25.26 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.67 -0.695 . . . . 13.83 109.425 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -73.6 36.59 0.39 Allowed 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 122.695 2.263 . . . . 15.34 113.451 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -109.77 -68.61 0.91 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.786 0.327 . . . . 16.890000000000001 110.545 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.64 20.68 8.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.335 -0.393 . . . . 15.140000000000001 110.806 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 24.2 t70 67.8 23.61 8.46 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.55 0.691 . . . . 14.94 110.406 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -82.87 142.98 31.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.055 -0.52 . . . . 12.949999999999999 111.217 -178.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 43.9 mt -87.27 113.5 24.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.191 -0.458 . . . . 11.44 110.274 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -77.46 -41.76 38.45 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 121.069 -0.252 . . . . 11.65 110.415 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 29.4 p90 -163.82 175.15 10.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.697 0.285 . . . . 10.35 110.353 178.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 60.2 mt -118.4 121.88 68.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 116.283 -0.417 . . . . 10.470000000000001 110.449 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.473 HG12 ' HG2' ' A' ' 15' ' ' ARG . 42.1 mt -90.26 107.65 18.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.704 -0.48 . . . . 9.3200000000000003 109.704 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.571 ' HB3' HG22 ' A' ' 90' ' ' THR . 72.8 m -98.96 112.7 24.74 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.186 0.517 . . . . 10.15 111.017 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.814 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 7.7 m -83.02 90.87 7.07 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.769 -0.826 . . . . 11.4 108.769 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.456 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 6.3 m-20 -79.29 94.63 5.5 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.825 -0.625 . . . . 11.640000000000001 111.67 -178.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 6.5 m -104.05 113.77 27.54 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.835 -0.431 . . . . 11.220000000000001 109.835 178.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . 0.491 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 9.4 t-20 -68.46 135.19 51.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.151 0.501 . . . . 12.98 111.097 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.402 HG11 ' HG3' ' A' ' 114' ' ' LYS . 40.7 t -109.3 -51.62 6.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.667 -0.697 . . . . 15.109999999999999 109.999 179.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.578 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 44.4 mtpt . . . . . 0 C--O 1.253 1.262 0 CA-C-O 118.276 -0.868 . . . . 16.32 109.917 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 22.0 m . . . . . 0 N--CA 1.478 0.946 0 CA-C-O 120.857 0.361 . . . . 7.8399999999999999 110.074 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -138.65 163.54 46.13 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.349 -0.387 . . . . 7.4900000000000002 110.77 -178.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.48 167.59 23.62 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.895 2.396 . . . . 6.4400000000000004 112.023 179.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' THR . . . . . 0.599 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.0 OUTLIER -83.17 58.49 4.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.235 0.54 . . . . 5.9800000000000004 111.145 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.652 ' HA ' ' O ' ' B' ' 110' ' ' ASN . 22.6 tt0 -162.09 129.05 3.79 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.496 -0.775 . . . . 5.8499999999999996 109.443 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -138.55 154.69 48.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.199 0.523 . . . . 6.4900000000000002 111.661 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . 0.631 ' HB ' ' HB2' ' B' ' 26' ' ' ASP . 10.5 mm -88.35 120.43 37.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.54 -0.755 . . . . 6.0199999999999996 110.664 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.696 ' HB3' ' HE2' ' B' ' 22' ' ' PHE . 0.7 OUTLIER -108.58 93.71 4.67 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.776 -0.647 . . . . 5.3700000000000001 110.374 179.723 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . 0.605 ' HD3' ' HB3' ' B' ' 24' ' ' PHE . 11.2 mtp85 -85.72 108.65 18.15 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.375 -0.602 . . . . 9.4600000000000009 109.375 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . 0.456 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 30.3 p80 -141.44 166.03 25.88 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.44 -0.345 . . . . 8.3100000000000005 111.14 -179.152 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 12.0 p-10 -79.36 -177.76 5.9 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.235 -0.439 . . . . 11.19 110.469 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . 0.449 HG13 ' N ' ' B' ' 19' ' ' GLU . 9.8 pt -59.1 -35.02 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 112.459 0.54 . . . . 9.3699999999999992 112.459 -178.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . 0.449 ' N ' HG13 ' B' ' 18' ' ' ILE . 18.2 mt-10 -71.87 -28.3 63.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.018 0.437 . . . . 11.92 111.29 -179.371 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 117.44 -1.91 18.43 Favored Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 120.428 -0.892 . . . . 8.6799999999999997 113.168 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . 0.453 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 36.9 mm -66.29 111.17 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.03 -0.359 . . . . 11.16 110.03 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . 0.696 ' HE2' ' HB3' ' B' ' 14' ' ' SER . 95.5 m-85 -66.85 130.92 44.72 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.175 -0.466 . . . . 8.5999999999999996 110.941 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 1.1 m -108.6 -27.55 9.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.923 -0.581 . . . . 7.9100000000000001 110.64 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . 0.605 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 15.7 t80 -160.21 137.19 9.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.014 -0.539 . . . . 8.5 109.97 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 10.9 t -125.69 146.06 32.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.429 -0.35 . . . . 6.5 110.811 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . 0.631 ' HB2' ' HB ' ' B' ' 13' ' ' ILE . 5.8 t0 -71.16 161.89 30.35 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.463 -0.569 . . . . 7.1500000000000004 109.463 179.036 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 17.1 m170 -80.26 37.03 0.37 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.811 0.339 . . . . 9.4100000000000001 111.251 -179.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . 0.511 ' HD2' ' O ' ' B' ' 11' ' ' GLU . 29.0 mtm180 -128.39 3.07 5.66 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.887 0.375 . . . . 9.7599999999999998 111.114 -179.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 1.8 p -62.74 -46.77 86.51 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 112.413 0.523 . . . . 11.56 112.413 -178.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 6.7 t -67.54 -26.48 35.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 121.079 0.466 . . . . 14.01 111.038 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.87 -22.13 43.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.217 -0.447 . . . . 12.9 111.108 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 13.0 m -92.57 -59.7 2.01 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.29 0.478 . . . . 12.34 112.29 -178.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' VAL . . . . . 0.559 HG11 HD21 ' B' ' 86' ' ' LEU . 3.2 m -118.63 -5.53 11.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 112.195 0.442 . . . . 13.869999999999999 112.195 -178.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.3 20.34 64.76 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.536 -0.84 . . . . 14.369999999999999 112.21 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' TYR . . . . . 0.456 ' HD1' ' HA ' ' B' ' 35' ' ' TYR . 1.0 OUTLIER -93.0 130.72 38.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.675 0.274 . . . . 15.56 110.909 -179.726 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -75.0 144.86 80.13 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 109.111 -0.7 . . . . 13.859999999999999 109.111 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.429 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 52.2 Cg_exo -54.52 -32.99 76.42 Favored 'Trans proline' 0 CA--C 1.529 0.233 0 C-N-CA 122.459 2.106 . . . . 15.210000000000001 112.23 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' GLN . . . . . 0.563 ' HA ' HD12 ' B' ' 41' ' ' LEU . 26.9 mp0 -75.52 -17.11 60.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.615 -0.721 . . . . 17.82 111.971 -179.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -75.54 -40.26 57.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.96 0.409 . . . . 14.42 110.574 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.513 ' HB3' ' CG ' ' B' ' 22' ' ' PHE . 1.9 mm? -74.84 -26.02 59.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.836 -0.62 . . . . 14.550000000000001 111.201 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . 0.563 HD12 ' HA ' ' B' ' 38' ' ' GLN . 75.3 mt -61.48 119.8 9.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 14.050000000000001 111.469 -179.095 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.6 11.72 79.32 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.834 -0.698 . . . . 11.68 113.055 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.567 ' HA ' ' HE2' ' B' ' 43' ' ' LYS . 8.6 mmpt? -121.88 158.58 28.67 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.754 0.311 . . . . 14.17 110.479 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' ASN . . . . . 0.532 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 12.4 m120 -94.16 139.94 30.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.055 -0.52 . . . . 10.74 109.84 179.44 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.6 tt -62.08 -24.48 34.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.996 0.427 . . . . 9.8800000000000008 111.378 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 6.3 p -71.88 -18.29 19.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.172 -0.467 . . . . 11.779999999999999 111.217 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . 0.532 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 38.1 mt-10 -75.81 -23.15 55.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.995 0.426 . . . . 11.890000000000001 111.031 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -110.09 22.05 16.05 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.023 -0.535 . . . . 14.279999999999999 110.092 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 51.4 t -110.6 150.87 28.34 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.682 -0.69 . . . . 10.81 110.451 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -59.64 126.24 82.19 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.807 -0.633 . . . . 12.029999999999999 109.576 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -47.29 -42.21 27.55 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.058 2.505 . . . . 11.869999999999999 113.58 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 9.1 mp0 -78.45 0.32 26.31 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 112.334 0.494 . . . . 9.2799999999999994 112.334 -179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -129.83 5.05 5.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.888 0.375 . . . . 7.5199999999999996 110.933 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -63.75 -43.46 96.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.104 -0.498 . . . . 6.5700000000000003 110.719 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 49.6 tp60 -63.63 -39.63 94.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.956 -0.566 . . . . 6.9900000000000002 109.535 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.78 -42.42 84.08 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.986 -0.552 . . . . 5.1399999999999997 110.498 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . 0.463 HD21 ' HA ' ' B' ' 57' ' ' LEU . 0.5 OUTLIER -63.72 -51.76 63.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 6.8200000000000003 110.269 179.489 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -58.79 -44.29 90.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.82 -0.627 . . . . 8.6899999999999995 110.878 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -59.25 -42.87 92.13 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.749 -0.66 . . . . 6.46 110.975 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 20.3 m -66.82 -34.02 76.9 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.867 -0.606 . . . . 5.5899999999999999 110.592 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 61' ' ' PHE . . . . . 0.418 ' O ' HG23 ' B' ' 65' ' ' VAL . 9.5 m-85 -64.64 -37.87 89.05 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.104 0.478 . . . . 8.3300000000000001 109.781 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 21.1 mm100 -63.99 -44.45 92.62 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.805 -0.634 . . . . 7.1500000000000004 110.524 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -68.08 -40.44 82.68 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.615 -0.721 . . . . 9.5299999999999994 111.776 -179.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.414 HG23 ' O ' ' B' ' 92' ' ' SER . 9.5 p -68.17 -28.57 41.39 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 C-N-CA 120.861 -0.336 . . . . 8.2200000000000006 110.512 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . 0.418 HG23 ' O ' ' B' ' 61' ' ' PHE . 20.3 t -71.46 -37.25 63.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.01 -0.737 . . . . 7.4299999999999997 109.01 178.113 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 18.3 mtpt -68.82 -37.52 79.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.527 -0.761 . . . . 10.52 110.278 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 48.2 mt -62.02 -49.45 75.99 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.909 -0.587 . . . . 7.5300000000000002 110.292 179.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 22.1 mttt 63.85 112.23 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 O-C-N 124.006 0.816 . . . . 8.0099999999999998 112.46 179.133 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 77.18 23.07 69.46 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.851 -0.69 . . . . 5.8700000000000001 112.72 178.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -129.8 166.16 20.48 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.818 0.342 . . . . 5.6299999999999999 110.697 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 71' ' ' VAL . . . . . 0.632 ' HB ' ' HD1' ' B' ' 93' ' ' PHE . 2.8 p -116.19 120.34 64.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.874 -0.603 . . . . 6.0599999999999996 110.874 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 46.3 tp -107.22 119.5 39.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.914 -0.584 . . . . 4.9299999999999997 109.96 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 73' ' ' SER . . . . . 0.422 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 0.9 OUTLIER -89.38 111.73 22.66 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.97 -0.559 . . . . 6.79 110.781 -179.48 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.4 p -110.84 132.39 59.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.859 -0.423 . . . . 4.4199999999999999 109.859 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 21.7 ttt -106.45 114.96 29.39 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.095 0.474 . . . . 5.6699999999999999 110.972 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.548 ' HE2' ' HD1' ' B' ' 78' ' ' PHE . 49.6 p90 -144.96 -175.35 4.65 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.505 -0.771 . . . . 3.75 108.998 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 77' ' ' ARG . . . . . 0.451 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 40.4 mtm180 -106.7 118.47 36.75 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.048 0.451 . . . . 7.3499999999999996 110.497 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . 0.548 ' HD1' ' HE2' ' B' ' 76' ' ' PHE . 14.8 t80 -97.13 145.66 25.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.297 -0.865 . . . . 5.79 110.201 -179.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 79' ' ' ARG . . . . . 0.531 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 22.4 ttp180 -85.8 129.72 34.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.3 -0.409 . . . . 11.529999999999999 110.676 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 80' ' ' SER . . . . . 0.524 ' HA ' ' HB ' ' B' ' 33' ' ' VAL . 88.6 p -89.77 -177.83 5.35 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.704 -0.48 . . . . 7.4699999999999998 109.704 178.628 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 51.6 tptt -68.47 -23.38 64.58 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.325 0.583 . . . . 12.67 109.547 178.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -86.13 4.66 37.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.631 -0.713 . . . . 9.25 110.349 178.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 67.07 29.23 8.04 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.45 -0.796 . . . . 8.75 111.469 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . 0.448 ' O ' ' HA ' ' B' ' 79' ' ' ARG . 1.7 pt-20 -95.88 152.91 18.07 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.153 -0.684 . . . . 6.8700000000000001 109.153 178.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . 0.531 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 73.2 m95 -104.31 93.89 5.06 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.792 0.33 . . . . 8.3800000000000008 110.384 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . 0.559 HD21 HG11 ' B' ' 33' ' ' VAL . 1.8 pp -96.99 148.8 22.6 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.224 -0.444 . . . . 7.25 110.494 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 87' ' ' TRP . . . . . 0.484 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 90.5 m95 -72.82 121.99 20.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.965 0.412 . . . . 9.3000000000000007 110.581 -179.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 27.2 tpp -122.47 131.62 53.95 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.782 -0.645 . . . . 4.46 110.981 -178.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 15.9 ttp180 -100.38 72.69 1.62 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.517 -0.92 . . . . 7.3099999999999996 108.517 178.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 90' ' ' THR . . . . . 0.502 HG22 ' HB3' ' B' ' 108' ' ' CYS . 54.0 m -66.81 113.02 4.56 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.201 -0.908 . . . . 6.1799999999999997 112.083 -178.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 91' ' ' SER . . . . . 0.422 ' HA ' ' HA ' ' B' ' 73' ' ' SER . 1.6 m -95.1 96.82 9.49 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.935 -0.765 . . . . 6.4500000000000002 108.935 178.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 92' ' ' SER . . . . . 0.457 ' O ' ' HA ' ' B' ' 71' ' ' VAL . 16.3 m -84.06 117.39 23.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.274 -0.421 . . . . 6.75 111.819 -178.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . 0.632 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 71.2 t80 -110.08 122.12 46.84 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.086 -0.506 . . . . 6.4500000000000002 110.161 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.3 118.4 26.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.755 0.312 . . . . 9.8800000000000008 111.01 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 95' ' ' PHE . . . . . 0.448 ' O ' ' HA ' ' B' ' 103' ' ' ILE . 0.0 OUTLIER -83.58 130.9 35.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.811 0.339 . . . . 8.9100000000000001 110.919 -179.837 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -104.71 111.04 23.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.964 -0.562 . . . . 10.99 110.958 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 97' ' ' ASN . . . . . 0.471 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 65.3 t30 -74.32 127.3 87.93 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 109.513 -0.551 . . . . 8.5099999999999998 109.513 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 98' ' ' PRO . . . . . 0.471 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 62.1 Cg_endo -74.71 20.02 0.45 Allowed 'Trans proline' 0 CA--C 1.535 0.554 0 C-N-CA 122.714 2.276 . . . . 9.1600000000000001 113.884 -179.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -91.69 -56.72 3.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.938 0.399 . . . . 11.390000000000001 110.1 179.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 100' ' ' SER . . . . . 0.406 ' HB2' ' HG3' ' B' ' 102' ' ' GLU . 1.4 m -135.95 16.46 3.28 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.531 -0.544 . . . . 7.9000000000000004 109.531 179.055 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 23.7 t70 63.84 40.26 7.68 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.232 -0.894 . . . . 9.0800000000000001 110.497 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . 0.406 ' HG3' ' HB2' ' B' ' 100' ' ' SER . 0.0 OUTLIER -96.83 158.87 15.22 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.708 -0.678 . . . . 7.71 110.481 179.948 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 103' ' ' ILE . . . . . 0.448 ' HA ' ' O ' ' B' ' 95' ' ' PHE . 68.7 mt -95.44 105.05 16.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.709 -0.478 . . . . 8.3800000000000008 109.709 179.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -60.59 -52.33 65.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.84 -0.618 . . . . 8.8100000000000005 110.962 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -164.37 171.16 15.13 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.613 -0.721 . . . . 7.8200000000000003 110.019 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 37.8 mt -108.47 119.54 58.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.952 -0.567 . . . . 7.2199999999999998 109.951 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 33.5 mt -86.6 97.98 6.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 109.443 -0.577 . . . . 6.7199999999999998 109.443 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 108' ' ' CYS . . . . . 0.502 ' HB3' HG22 ' B' ' 90' ' ' THR . 92.5 m -92.68 104.38 16.66 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.178 0.436 . . . . 5.3099999999999996 112.178 -179.103 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 109' ' ' THR . . . . . 0.408 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 3.5 m -78.28 97.46 5.57 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.606 -0.887 . . . . 5.8700000000000001 108.606 177.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 110' ' ' ASN . . . . . 0.652 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.2 m-20 -80.56 89.02 5.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.012 -0.54 . . . . 6.9000000000000004 111.78 -178.118 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 3.3 m -94.78 112.55 24.28 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.199 -0.455 . . . . 8.9000000000000004 110.496 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 112' ' ' ASN . . . . . 0.599 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 4.2 t-20 -70.49 131.66 44.37 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.068 0.461 . . . . 11.84 110.779 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 93.5 t -104.79 -55.94 5.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.591 -0.732 . . . . 12.4 109.986 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . 0.484 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 42.2 mtpt . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.197 -0.906 . . . . 12.68 109.937 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 . . . . . 0 C--O 1.232 0.15 0 N-CA-C 110.239 -0.282 . . . . 15.44 110.239 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -65.75 154.32 74.38 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.572 2.181 . . . . 14.109999999999999 111.94 179.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' THR . . . . . 0.7 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.8 OUTLIER -77.35 43.25 0.37 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.229 0.538 . . . . 11.369999999999999 111.33 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.56 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 32.8 tt0 -145.75 126.48 14.33 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.852 -0.796 . . . . 10.59 108.852 -179.306 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.955 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 33.5 p90 -145.35 156.42 43.78 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.088 0.47 . . . . 9.1999999999999993 111.342 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.537 HG21 HG21 ' A' ' 107' ' ' ILE . 21.8 mm -85.31 117.13 29.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.681 -0.69 . . . . 8.9399999999999995 110.995 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.41 ' HB3' ' HE1' ' A' ' 22' ' ' PHE . 0.8 OUTLIER -105.75 92.5 4.2 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.119 -0.492 . . . . 6.1100000000000003 110.294 179.481 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 15' ' ' ARG . 6.4 mtt180 -81.48 117.59 22.03 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.482 -0.562 . . . . 9.4600000000000009 109.482 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.1 p80 -149.16 159.28 44.38 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.921 -0.311 . . . . 10.369999999999999 111.041 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.2 p-10 -80.76 178.06 8.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.308 -0.406 . . . . 13.279999999999999 110.349 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.9 pt -58.56 -28.07 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 113.087 0.773 . . . . 13.970000000000001 113.087 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -75.06 -23.65 58.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.28 0.562 . . . . 13.85 110.878 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 112.84 -7.27 25.74 Favored Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 120.841 -0.695 . . . . 9.6099999999999994 111.748 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.452 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 38.9 mm -66.88 115.19 4.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 110.011 -0.366 . . . . 11.289999999999999 110.011 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.445 ' CZ ' ' HB ' ' A' ' 45' ' ' ILE . 98.0 m-85 -71.37 128.59 36.38 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.953 -0.567 . . . . 10.449999999999999 111.402 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 23.4 p -95.04 -31.59 13.52 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.25 -0.886 . . . . 8.1300000000000008 110.102 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -155.47 132.16 10.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.465 -0.789 . . . . 7.4900000000000002 109.423 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.637 HG21 ' HB2' ' A' ' 40' ' ' LEU . 21.6 t -116.99 143.38 27.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.722 0.296 . . . . 6.4500000000000002 110.972 -179.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.955 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 6.9 t70 -67.23 166.03 14.98 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.76 -0.654 . . . . 7.3099999999999996 110.396 179.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 51.5 m170 -87.82 -13.28 42.58 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.928 0.395 . . . . 12.41 110.648 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.463 HH22 HG23 ' B' ' 107' ' ' ILE . 79.2 mtm180 -81.73 -1.96 48.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.227 -0.442 . . . . 12.19 112.033 -179.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 29.2 p -65.04 -30.45 71.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.945 0.402 . . . . 13.5 111.257 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.402 HG12 HE22 ' A' ' 36' ' ' GLN . 24.7 t -61.47 -39.72 83.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.838 -0.619 . . . . 16.559999999999999 111.665 -179.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.73 -18.19 33.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.703 0.287 . . . . 15.07 111.426 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.3 m -85.09 -53.3 5.36 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.344 -0.389 . . . . 15.26 111.917 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.412 HG23 ' H ' ' A' ' 35' ' ' TYR . 3.7 m -123.5 -15.5 5.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.2 0.445 . . . . 14.18 112.2 -179.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 92.41 -13.82 66.28 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.439 -0.886 . . . . 13.85 111.833 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.412 ' H ' HG23 ' A' ' 33' ' ' VAL . 4.7 m-30 -71.46 133.04 45.6 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.679 -0.26 . . . . 18.59 110.58 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.493 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 37.3 mm-40 -78.25 150.77 77.65 Favored Pre-proline 0 C--N 1.321 -0.668 0 N-CA-C 108.445 -0.946 . . . . 15.890000000000001 108.445 178.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.605 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 74.5 Cg_exo -50.22 -43.17 44.43 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.468 2.112 . . . . 12.26 112.515 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -63.49 -22.51 66.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.001 -0.545 . . . . 13.68 112.099 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.493 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 36.5 mt-10 -74.9 -22.54 58.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.852 0.358 . . . . 17.34 110.922 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.637 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.9 mm? -98.14 -30.07 12.86 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.124 -0.489 . . . . 13.56 110.792 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 92.3 mt -62.77 108.28 1.14 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 13.42 111.217 -179.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 97.04 2.86 59.21 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.894 -0.67 . . . . 13.390000000000001 112.153 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.79 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 4.1 mmpt? -112.4 158.26 20.04 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 110.331 -0.248 . . . . 17.239999999999998 110.331 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.794 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 15.4 m120 -94.01 135.86 34.91 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.973 -0.38 . . . . 12.77 109.973 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.445 ' HB ' ' CZ ' ' A' ' 22' ' ' PHE . 13.8 tt -63.79 -27.34 42.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.014 0.435 . . . . 12.050000000000001 110.501 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 6.1 p -68.5 -17.72 22.47 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 116.086 -0.507 . . . . 13.390000000000001 111.392 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.794 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 34.9 mt-10 -78.49 -35.04 47.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.939 0.4 . . . . 16.530000000000001 111.143 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.439 ' HE2' ' HB3' ' A' ' 43' ' ' LYS . 48.8 m-85 -95.46 6.44 48.97 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.183 0.516 . . . . 15.83 110.752 -179.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 48.9 t -93.75 154.66 17.65 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.807 -0.633 . . . . 12.01 110.343 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.517 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 3.7 t-160 -62.43 128.44 91.37 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.647 -0.706 . . . . 15.130000000000001 109.512 179.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -44.6 -50.47 8.18 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 123.195 2.597 . . . . 15.83 114.25 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -73.1 -11.56 60.59 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.794 0.294 . . . . 16.690000000000001 111.794 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.517 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 5.5 m-20 -107.29 -0.16 22.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.863 0.363 . . . . 13.16 110.881 -179.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -60.89 -50.21 74.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.046 -0.524 . . . . 16.170000000000002 111.17 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -64.38 -36.05 82.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.786 0.327 . . . . 14.35 110.24 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 29.7 tp -58.1 -45.41 87.27 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.2 0.524 . . . . 12.51 109.744 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.453 HD21 ' HA ' ' A' ' 57' ' ' LEU . 0.4 OUTLIER -68.12 -47.23 68.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.481 -0.781 . . . . 10.08 109.984 179.041 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 36.9 ttt180 -54.26 -47.22 72.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.213 -0.903 . . . . 11.710000000000001 111.279 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -64.61 -43.86 92.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.133 -0.485 . . . . 9.7100000000000009 110.924 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.7 m -60.04 -35.28 74.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.342 -0.39 . . . . 9.5199999999999996 110.645 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.536 ' O ' HG12 ' A' ' 64' ' ' VAL . 7.4 m-85 -65.28 -46.09 81.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.321 -0.4 . . . . 12.109999999999999 110.19 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -66.27 -34.97 79.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.195 0.522 . . . . 10.289999999999999 109.944 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -63.87 -40.67 97.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.667 -0.697 . . . . 10.619999999999999 110.61 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.536 HG12 ' O ' ' A' ' 61' ' ' PHE . 0.4 OUTLIER -70.02 -25.63 28.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 116.564 -0.289 . . . . 10.93 110.872 -179.731 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 61' ' ' PHE . 75.5 t -69.03 -37.79 77.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 109.026 -0.731 . . . . 12.890000000000001 109.026 178.301 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 48.5 mtpt -76.5 -28.52 56.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.252 -0.886 . . . . 16.68 110.242 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.609 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 58.3 mt -71.71 -56.74 5.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.466 . . . . 13.18 110.79 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 65' ' ' VAL . 78.7 mttt 62.47 104.96 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 O-C-N 123.727 0.642 . . . . 15.17 112.315 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.04 -4.03 86.58 Favored Glycine 0 N--CA 1.454 -0.16 0 C-N-CA 120.716 -0.754 . . . . 10.01 112.942 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.609 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 7.1 tp-100 -101.53 130.31 47.78 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.67 -0.493 . . . . 10.039999999999999 109.67 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 2.7 p -83.29 107.26 14.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.288 0.566 . . . . 8.5399999999999991 110.251 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 20.1 tp -100.08 110.98 23.28 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.996 -0.547 . . . . 8.1300000000000008 110.312 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.462 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 0.0 OUTLIER -89.23 108.6 19.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.998 -0.546 . . . . 7.8899999999999997 111.096 -179.612 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.3 p -100.36 125.35 54.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.13 -0.486 . . . . 8.1799999999999997 109.758 178.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 23.0 ttt -100.52 106.87 18.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.341 -0.391 . . . . 9.6999999999999993 110.349 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.503 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 46.0 p90 -134.25 -174.47 3.56 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.815 -0.63 . . . . 10.27 110.159 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.475 ' HB2' ' HB2' ' A' ' 50' ' ' HIS . 47.4 mtt180 -105.08 117.14 33.25 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.184 -0.462 . . . . 13.859999999999999 110.195 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.503 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 11.4 t80 -107.03 147.6 29.74 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.019 -0.537 . . . . 9.7300000000000004 109.888 -179.526 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.533 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 35.2 ttp180 -87.9 136.47 32.95 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.852 0.358 . . . . 11.300000000000001 110.885 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.421 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 66.0 p -96.52 -174.39 3.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.103 -0.499 . . . . 11.039999999999999 109.999 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.424 ' HD2' ' HA ' ' A' ' 81' ' ' LYS . 42.1 tptt -70.65 -14.25 62.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.346 0.593 . . . . 13.18 109.841 178.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -92.6 3.1 56.2 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.782 -0.644 . . . . 14.890000000000001 109.624 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 67.4 20.7 9.88 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.4 -0.818 . . . . 12.92 111.172 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.421 ' HG2' ' OG ' ' A' ' 80' ' ' SER . 3.2 pt-20 -96.07 153.47 17.76 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.357 -0.608 . . . . 10.94 109.357 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.533 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 67.1 m95 -100.29 112.17 24.49 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.892 0.377 . . . . 11.77 110.676 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.456 HD11 HD21 ' A' ' 112' ' ' ASN . 1.5 pp -110.02 156.04 21.04 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.241 -0.436 . . . . 11.57 110.643 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.506 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 82.5 m95 -81.67 114.65 20.48 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.197 0.523 . . . . 10.73 110.786 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 38.1 tpp -114.92 131.54 56.84 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.435 -0.802 . . . . 9.7400000000000002 110.886 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.6 ttp180 -101.52 76.84 1.71 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.838 -0.801 . . . . 11.16 108.838 178.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.709 HG23 ' HB3' ' A' ' 108' ' ' CYS . 36.7 m -67.33 109.58 3.2 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.381 -0.827 . . . . 9.5899999999999999 112.066 -178.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.462 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 0.7 OUTLIER -90.25 88.8 7.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.265 -0.879 . . . . 8.8800000000000008 109.442 179.506 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.1 m -74.07 131.27 41.17 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.95 -0.568 . . . . 8.9399999999999995 111.897 -178.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -130.3 122.43 27.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.878 -0.601 . . . . 12.1 110.176 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.26 119.24 18.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.402 -0.363 . . . . 10.16 111.388 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -101.52 106.97 18.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.942 0.401 . . . . 12.6 109.997 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -104.01 152.02 22.53 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.086 -0.506 . . . . 14.6 111.335 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.435 ' HB3' ' OE1' ' A' ' 102' ' ' GLU . 11.4 t-20 -86.3 133.03 41.4 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 108.79 -0.818 . . . . 13.83 108.79 178.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.62 14.4 0.41 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 122.81 2.34 . . . . 15.34 113.898 -178.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -87.29 -54.72 4.15 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.883 0.373 . . . . 16.890000000000001 110.294 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 18.8 m -142.38 19.91 2.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.142 -0.481 . . . . 15.140000000000001 110.179 178.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 18.4 t70 67.93 32.15 5.28 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.703 -0.681 . . . . 14.94 110.561 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . 0.435 ' OE1' ' HB3' ' A' ' 97' ' ' ASN . 1.6 mp0 -76.5 122.6 24.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.014 -0.539 . . . . 12.949999999999999 110.089 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 50.9 mt -70.57 108.56 2.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 109.993 -0.373 . . . . 11.44 109.993 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -72.78 -54.32 9.21 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.057 -0.52 . . . . 11.65 110.281 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -162.4 179.67 7.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.667 -0.697 . . . . 10.35 110.066 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 56.5 mt -115.64 117.89 57.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.222 -0.445 . . . . 10.470000000000001 110.468 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.632 HG23 HH22 ' B' ' 15' ' ' ARG . 33.4 mt -89.5 102.91 13.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.51 -0.552 . . . . 9.3200000000000003 109.51 179.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.709 ' HB3' HG23 ' A' ' 90' ' ' THR . 99.5 m -97.15 112.69 24.36 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.227 0.537 . . . . 10.15 111.828 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.421 HG23 HG23 ' B' ' 13' ' ' ILE . 1.6 m -80.66 98.14 7.56 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 108.652 -0.87 . . . . 11.4 108.652 178.211 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.56 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 4.5 m-20 -80.55 99.84 8.29 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.148 -0.478 . . . . 11.640000000000001 111.544 -178.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.424 HG22 ' HB2' ' A' ' 11' ' ' GLU . 3.1 m -106.22 109.74 21.77 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.863 -0.608 . . . . 11.220000000000001 109.976 178.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . 0.7 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 5.0 t-20 -75.19 134.88 41.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.881 0.372 . . . . 12.98 110.719 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.581 HG11 ' HG3' ' A' ' 114' ' ' LYS . 76.8 t -111.34 -50.55 6.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.91 -0.586 . . . . 15.109999999999999 109.9 179.388 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.581 ' HG3' HG11 ' A' ' 113' ' ' VAL . 61.3 mtpt . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.142 -0.932 . . . . 16.32 110.024 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 41.9 m . . . . . 0 N--CA 1.479 0.996 0 CA-C-O 121.05 0.453 . . . . 7.8399999999999999 109.922 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' GLN . . . . . 0.449 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 26.4 mm-40 -124.88 135.94 27.38 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.287 -0.415 . . . . 7.4900000000000002 110.604 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' PRO . . . . . 0.457 ' HD2' ' HG2' ' B' ' 28' ' ' ARG . 37.6 Cg_exo -61.06 154.8 54.49 Favored 'Trans proline' 0 CA--C 1.53 0.306 0 C-N-CA 122.763 2.308 . . . . 6.4400000000000004 112.309 179.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.33 46.57 1.05 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.494 0.664 . . . . 5.9800000000000004 110.654 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.624 ' HA ' ' O ' ' B' ' 110' ' ' ASN . 62.3 tt0 -155.68 115.52 3.67 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.168 -0.923 . . . . 5.8499999999999996 108.584 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' PHE . . . . . 0.609 ' HB3' ' HB2' ' B' ' 28' ' ' ARG . 33.9 p90 -137.23 155.99 48.84 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.505 0.557 . . . . 6.4900000000000002 112.505 -178.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . 0.485 HG13 HG21 ' B' ' 107' ' ' ILE . 3.4 tt -84.8 118.94 32.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.42 -0.809 . . . . 6.0199999999999996 110.741 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.76 100.87 10.41 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.042 -0.527 . . . . 5.3700000000000001 110.008 179.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . 0.632 HH22 HG23 ' A' ' 107' ' ' ILE . 9.4 mtp180 -88.88 105.1 17.52 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.882 -0.414 . . . . 9.4600000000000009 109.882 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 34.5 p80 -131.71 155.94 46.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.952 -0.567 . . . . 8.3100000000000005 110.217 -179.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -74.58 173.42 10.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.62 -0.264 . . . . 11.19 110.406 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.5 pt -56.78 -31.15 34.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 N-CA-C 112.846 0.684 . . . . 9.3699999999999992 112.846 -178.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -71.15 -27.52 63.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.021 0.439 . . . . 11.92 111.254 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 117.82 -2.97 17.35 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.565 -0.826 . . . . 8.6799999999999997 112.664 179.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . 0.401 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 19.3 mm -75.31 123.51 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 110.152 -0.314 . . . . 11.16 110.152 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . 0.526 ' CZ ' ' HB ' ' B' ' 45' ' ' ILE . 97.2 m-85 -74.74 130.65 39.87 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.877 0.37 . . . . 8.5999999999999996 111.254 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 19.4 m -102.38 -39.95 6.94 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.982 -0.554 . . . . 7.9100000000000001 110.309 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . 0.434 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 44.0 t80 -152.12 134.03 14.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.945 -0.57 . . . . 8.5 109.897 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 2.0 m -131.56 156.66 42.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.539 -0.301 . . . . 6.5 110.589 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . 0.519 ' HB3' ' HB2' ' B' ' 12' ' ' PHE . 11.8 t70 -81.95 158.98 23.7 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.04 -0.527 . . . . 7.1500000000000004 110.466 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -67.92 -17.7 64.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.306 -0.406 . . . . 9.4100000000000001 111.475 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . 0.624 ' HD2' ' O ' ' B' ' 11' ' ' GLU . 65.5 mtm180 -62.98 -16.82 60.96 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.255 -0.429 . . . . 9.7599999999999998 111.858 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 29.3 p -60.21 -36.3 77.36 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.749 0.309 . . . . 11.56 111.654 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . 0.478 ' O ' ' HA2' ' B' ' 34' ' ' GLY . 47.3 t -63.25 -31.42 52.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.972 -0.558 . . . . 14.01 111.34 -179.231 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -91.16 -21.09 21.34 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.809 0.338 . . . . 12.9 111.308 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 26.0 m -82.92 -57.05 3.46 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.066 0.395 . . . . 12.34 112.066 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' VAL . . . . . 0.556 HG13 ' HD2' ' B' ' 78' ' ' PHE . 0.2 OUTLIER -117.31 -11.68 11.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 111.83 0.307 . . . . 13.869999999999999 111.83 -179.391 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' GLY . . . . . 0.478 ' HA2' ' O ' ' B' ' 30' ' ' VAL . . . 90.01 -0.82 79.57 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.506 -0.854 . . . . 14.369999999999999 112.364 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 -79.57 132.51 36.31 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.654 0.264 . . . . 15.56 111.033 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . 0.439 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 80.8 mm-40 -76.6 147.12 77.96 Favored Pre-proline 0 C--N 1.321 -0.674 0 N-CA-C 107.993 -1.114 . . . . 13.859999999999999 107.993 177.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.623 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 72.5 Cg_exo -49.86 -39.93 48.66 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.561 2.174 . . . . 15.210000000000001 112.878 -179.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -66.93 -17.03 64.72 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.914 -0.584 . . . . 17.82 112.531 -179.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.439 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 33.2 mt-10 -78.74 -32.21 46.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.885 0.374 . . . . 14.42 110.648 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.487 ' O ' ' HB2' ' B' ' 22' ' ' PHE . 1.8 mm? -82.88 -30.7 28.34 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.067 -0.515 . . . . 14.550000000000001 110.985 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 58.8 mt -61.7 104.8 0.47 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.253 -0.43 . . . . 14.050000000000001 111.668 -179.114 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 100.69 5.81 53.38 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.85 -0.69 . . . . 11.68 112.85 179.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.66 ' HA ' ' HE2' ' B' ' 43' ' ' LYS . 6.1 mmpt? -118.85 157.31 27.86 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.612 0.244 . . . . 14.17 110.68 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' ASN . . . . . 0.765 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 18.8 m120 -93.4 137.1 33.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.235 -0.438 . . . . 10.74 110.177 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . 0.526 ' HB ' ' CZ ' ' B' ' 22' ' ' PHE . 14.1 tt -59.69 -29.42 42.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.143 0.497 . . . . 9.8800000000000008 110.952 179.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 7.9 p -69.63 -20.91 24.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.991 -0.549 . . . . 11.779999999999999 111.401 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . 0.765 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 38.6 mt-10 -74.15 -20.78 60.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.926 0.393 . . . . 11.890000000000001 110.935 -179.56 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -112.04 18.87 18.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.101 0.477 . . . . 14.279999999999999 109.906 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 51.9 t -102.88 151.62 22.23 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.818 -0.628 . . . . 10.81 110.636 -179.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' HIS . . . . . 0.605 ' HB3' ' HB2' ' B' ' 53' ' ' ASP . 5.0 t-80 -57.36 130.22 80.56 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.835 -0.62 . . . . 12.029999999999999 109.472 178.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -46.49 -45.77 18.66 Favored 'Trans proline' 0 CA--C 1.534 0.481 0 C-N-CA 123.048 2.499 . . . . 11.869999999999999 113.587 -179.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -82.34 6.55 16.66 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.138 0.421 . . . . 9.2799999999999994 112.138 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . 0.605 ' HB2' ' HB3' ' B' ' 50' ' ' HIS . 5.2 m-20 -125.1 -0.7 7.78 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.033 0.444 . . . . 7.5199999999999996 110.498 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -64.4 -46.88 81.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.835 -0.62 . . . . 6.5700000000000003 111.102 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 49.2 tp60 -61.51 -42.16 98.38 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.108 -0.497 . . . . 6.9900000000000002 110.402 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 65.4 tp -59.44 -42.09 91.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.081 -0.509 . . . . 5.1399999999999997 110.28 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . 0.456 HD21 ' HA ' ' B' ' 57' ' ' LEU . 0.5 OUTLIER -62.87 -49.95 72.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.089 -0.505 . . . . 6.8200000000000003 110.043 179.356 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -58.18 -46.04 86.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.435 -0.802 . . . . 8.6899999999999995 111.239 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -62.7 -38.69 91.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.095 -0.502 . . . . 6.46 111.197 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 31.0 m -68.74 -36.79 78.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.149 -0.478 . . . . 5.5899999999999999 110.982 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 61' ' ' PHE . . . . . 0.606 ' O ' HG12 ' B' ' 64' ' ' VAL . 8.2 m-85 -62.51 -46.46 88.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.759 0.314 . . . . 8.3300000000000001 110.738 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -67.04 -27.69 67.6 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.933 0.397 . . . . 7.1500000000000004 110.555 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.534 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 18.2 mt-30 -72.53 -42.06 65.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.048 -0.524 . . . . 9.5299999999999994 110.933 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.606 HG12 ' O ' ' B' ' 61' ' ' PHE . 3.2 p -66.04 -25.13 35.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.802 0.334 . . . . 8.2200000000000006 110.31 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . 0.507 HG23 ' O ' ' B' ' 61' ' ' PHE . 89.3 t -72.22 -32.56 43.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 109.264 -0.643 . . . . 7.4299999999999997 109.264 178.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -71.84 -34.72 69.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.65 -0.704 . . . . 10.52 110.182 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' B' ' 63' ' ' GLN . 24.3 mt -68.94 -51.18 42.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.772 -0.649 . . . . 7.5300000000000002 109.975 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 31.1 mttt 59.44 102.31 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 O-C-N 124.12 0.887 . . . . 8.0099999999999998 112.383 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.63 16.61 54.62 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.649 -0.786 . . . . 5.8700000000000001 112.328 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -126.45 162.16 26.25 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 110.275 -0.269 . . . . 5.6299999999999999 110.275 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 71' ' ' VAL . . . . . 0.401 ' HA ' ' O ' ' B' ' 92' ' ' SER . 24.8 t -106.88 121.09 59.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.342 -0.39 . . . . 6.0599999999999996 111.125 -179.017 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 21.2 tp -115.81 104.09 11.3 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.216 -0.661 . . . . 4.9299999999999997 109.216 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 73' ' ' SER . . . . . 0.491 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.4 m -86.21 117.97 25.37 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.908 -0.587 . . . . 6.79 111.032 -179.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.7 p -103.86 129.05 56.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.024 -0.534 . . . . 4.4199999999999999 110.21 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 75' ' ' MET . . . . . 0.433 ' HE1' ' HB ' ' B' ' 113' ' ' VAL . 10.7 tpt -100.47 117.1 33.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.124 -0.489 . . . . 5.6699999999999999 110.362 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -154.31 -171.91 4.03 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.393 -0.367 . . . . 3.75 110.205 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 77' ' ' ARG . . . . . 0.57 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 11.8 mtm180 -108.59 119.33 39.19 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.961 0.41 . . . . 7.3499999999999996 110.62 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . 0.556 ' HD2' HG13 ' B' ' 33' ' ' VAL . 19.5 t80 -102.38 144.78 30.43 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.482 -0.781 . . . . 5.79 110.03 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 79' ' ' ARG . . . . . 0.563 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 35.7 ttp180 -80.34 136.54 36.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.725 0.298 . . . . 11.529999999999999 110.517 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 80' ' ' SER . . . . . 0.698 ' HG ' ' HG2' ' B' ' 84' ' ' GLU . 88.9 p -99.26 -176.34 3.27 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.866 -0.42 . . . . 7.4699999999999998 109.866 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . 0.415 ' HD2' ' HA ' ' B' ' 81' ' ' LYS . 32.2 tptt -70.19 -10.42 58.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.566 0.698 . . . . 12.67 109.688 178.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 33.2 m-20 -96.39 3.49 52.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.416 -0.811 . . . . 9.25 109.796 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 67.49 17.5 10.04 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.511 -0.768 . . . . 8.75 111.327 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . 0.698 ' HG2' ' HG ' ' B' ' 80' ' ' SER . 7.1 pt-20 -94.91 158.94 15.26 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.236 -0.653 . . . . 6.8700000000000001 109.236 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . 0.57 ' HB3' ' HB3' ' B' ' 77' ' ' ARG . 42.2 m95 -106.48 108.65 20.27 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 121.03 -0.268 . . . . 8.3800000000000008 110.631 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' B' ' 77' ' ' ARG . 1.9 pp -105.57 152.68 22.77 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.345 -0.388 . . . . 7.25 110.129 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 87' ' ' TRP . . . . . 0.79 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 95.1 m95 -80.88 120.32 24.56 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.034 0.445 . . . . 9.3000000000000007 110.835 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 2.0 ttp -132.0 140.48 48.95 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.929 -0.578 . . . . 4.46 110.889 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 28.5 ttp180 -103.01 93.89 5.26 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.776 -0.647 . . . . 7.3099999999999996 109.36 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 90' ' ' THR . . . . . 0.543 ' CG2' ' HB3' ' B' ' 108' ' ' CYS . 6.4 m -78.47 105.37 9.69 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.014 -0.539 . . . . 6.1799999999999997 111.281 -179.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 91' ' ' SER . . . . . 0.491 ' HA ' ' HA ' ' B' ' 73' ' ' SER . 0.9 OUTLIER -84.05 94.86 8.41 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.65 -0.704 . . . . 6.4500000000000002 109.973 179.657 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 92' ' ' SER . . . . . 0.401 ' O ' ' HA ' ' B' ' 71' ' ' VAL . 8.6 m -84.73 127.18 33.98 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.366 -0.379 . . . . 6.75 111.939 -178.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -125.24 131.0 53.2 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.21 -0.45 . . . . 6.4500000000000002 109.904 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 94' ' ' THR . . . . . 0.448 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.0 OUTLIER -89.28 114.36 25.72 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.472 -0.331 . . . . 9.8800000000000008 110.797 179.644 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -102.45 122.81 45.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.917 0.389 . . . . 8.9100000000000001 110.423 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -106.6 147.65 29.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.968 -0.56 . . . . 10.99 110.533 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 97' ' ' ASN . . . . . 0.427 ' HB3' ' CD2' ' B' ' 99' ' ' TYR . 3.4 m-80 -85.11 147.25 47.26 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 115.972 -0.558 . . . . 8.5099999999999998 110.221 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -78.61 49.83 3.21 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.8 2.333 . . . . 9.1600000000000001 112.999 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . 0.427 ' CD2' ' HB3' ' B' ' 97' ' ' ASN . 51.3 m-85 -128.71 -58.14 1.17 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.999 0.428 . . . . 11.390000000000001 110.366 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.13 21.01 2.8 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.191 -0.459 . . . . 7.9000000000000004 110.538 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 32.7 t70 62.83 32.76 15.7 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.779 0.8 . . . . 9.0800000000000001 110.005 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -85.7 140.42 30.54 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.481 -0.781 . . . . 7.71 110.783 -179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 25.5 mt -84.94 117.74 30.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.322 -0.399 . . . . 8.3800000000000008 110.028 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -75.7 -46.37 31.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.909 0.385 . . . . 8.8100000000000005 110.045 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -165.49 172.48 12.05 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.796 -0.638 . . . . 7.8200000000000003 109.643 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 54.3 mt -106.37 115.89 48.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 109.952 -0.388 . . . . 7.2199999999999998 109.952 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . 0.485 HG21 HG13 ' B' ' 13' ' ' ILE . 77.0 mt -81.9 105.55 11.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.753 -0.658 . . . . 6.7199999999999998 109.741 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 108' ' ' CYS . . . . . 0.543 ' HB3' ' CG2' ' B' ' 90' ' ' THR . 94.4 m -107.85 99.0 8.51 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 120.863 0.363 . . . . 5.3099999999999996 111.948 -179.101 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 94.4 m -75.64 105.54 6.73 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.413 -0.958 . . . . 5.8700000000000001 108.413 177.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 110' ' ' ASN . . . . . 0.624 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 3.7 m-20 -81.85 101.18 10.03 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.718 -0.674 . . . . 6.9000000000000004 111.671 -178.108 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 20.4 m -101.56 107.43 18.71 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.814 -0.63 . . . . 8.9000000000000004 110.301 179.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -70.86 135.76 48.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.787 0.327 . . . . 11.84 110.502 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 113' ' ' VAL . . . . . 0.433 ' HB ' ' HE1' ' B' ' 75' ' ' MET . 37.1 t -113.37 -53.46 5.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.005 -0.543 . . . . 12.4 110.009 179.535 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . 0.79 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 46.4 mtpt . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.283 -0.865 . . . . 12.68 109.817 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 78.6 mm-40 . . . . . 0 N--CA 1.453 -0.301 0 N-CA-C 109.582 -0.525 . . . . 15.44 109.582 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -61.12 150.83 82.5 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 123.089 2.526 . . . . 14.109999999999999 112.32 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' THR . . . . . 0.807 HG21 ' HA ' ' A' ' 32' ' ' THR . 0.0 OUTLIER -82.96 51.39 1.92 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.27 0.557 . . . . 11.369999999999999 110.8 -179.861 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.622 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 30.7 tt0 -153.71 116.26 4.42 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.602 -0.888 . . . . 10.59 108.602 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.967 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 41.3 p90 -130.95 166.39 21.07 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.984 0.421 . . . . 9.1999999999999993 111.579 -178.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.53 HD11 HG21 ' A' ' 109' ' ' THR . 30.9 mm -94.77 121.28 45.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.854 -0.612 . . . . 8.9399999999999995 110.665 -179.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.613 ' HB3' ' HE2' ' A' ' 22' ' ' PHE . 0.7 OUTLIER -106.54 97.1 6.93 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.159 -0.473 . . . . 6.1100000000000003 110.878 179.588 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.411 ' HB2' ' HB3' ' A' ' 24' ' ' PHE . 3.5 mtt180 -83.17 102.41 11.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.763 -0.829 . . . . 9.4600000000000009 108.763 178.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.428 ' O ' ' HB2' ' A' ' 105' ' ' TYR . 34.4 p80 -132.18 158.7 41.03 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 121.149 -0.22 . . . . 10.369999999999999 111.265 -178.555 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -77.92 178.23 7.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.487 -0.324 . . . . 13.279999999999999 110.235 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 22.2 pt -54.55 -37.04 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 113.374 0.879 . . . . 13.970000000000001 113.374 -178.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -73.17 -25.66 60.88 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.039 0.447 . . . . 13.85 111.568 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 116.35 1.09 20.39 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.449 -0.882 . . . . 9.6099999999999994 112.198 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.424 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 37.0 mm -67.89 114.37 4.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 109.728 -0.471 . . . . 11.289999999999999 109.728 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.613 ' HE2' ' HB3' ' A' ' 14' ' ' SER . 78.8 m-85 -67.32 126.27 28.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.143 -0.48 . . . . 10.449999999999999 110.907 -179.703 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.2 m -106.29 -26.02 11.7 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.68 -0.691 . . . . 8.1300000000000008 109.754 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . 0.458 ' HE2' ' HE1' ' B' ' 95' ' ' PHE . 78.1 t80 -152.42 116.2 4.83 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.646 -0.706 . . . . 7.4900000000000002 109.615 179.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.581 HG21 ' HB2' ' A' ' 40' ' ' LEU . 19.3 t -112.27 127.48 69.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.347 -0.388 . . . . 6.4500000000000002 110.763 -179.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.967 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 10.1 t70 -66.38 136.28 55.54 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.145 -0.48 . . . . 7.3099999999999996 110.08 179.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -57.61 -16.3 9.99 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.896 0.702 . . . . 12.41 112.896 -179.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.43 ' HB2' ' HB3' ' A' ' 12' ' ' PHE . 80.1 mtm180 -67.95 -10.57 54.51 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.216 -0.302 . . . . 12.19 111.077 179.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 29.1 p -59.89 -31.46 69.82 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.726 0.298 . . . . 13.5 110.914 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 20.4 t -65.01 -36.55 78.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.185 -0.461 . . . . 16.559999999999999 110.823 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.05 -16.27 38.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.933 0.397 . . . . 15.07 110.922 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.807 ' HA ' HG21 ' A' ' 10' ' ' THR . 25.8 m -87.97 -56.64 3.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.019 -0.537 . . . . 15.26 111.594 -179.579 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.631 ' HB ' ' HA ' ' A' ' 80' ' ' SER . 7.7 m -121.47 -19.41 4.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 111.924 0.342 . . . . 14.18 111.924 -179.49 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.2 -18.27 56.82 Favored Glycine 0 N--CA 1.454 -0.145 0 C-N-CA 120.602 -0.809 . . . . 13.85 112.273 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -66.37 136.92 56.46 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.624 0.249 . . . . 18.59 110.483 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.481 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 33.6 mm-40 -76.24 150.6 83.01 Favored Pre-proline 0 C--N 1.326 -0.437 0 N-CA-C 109.37 -0.604 . . . . 15.890000000000001 109.37 179.207 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.527 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 52.6 Cg_exo -52.47 -41.97 64.27 Favored 'Trans proline' 0 CA--C 1.527 0.162 0 C-N-CA 122.529 2.153 . . . . 12.26 112.528 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.467 ' HA ' HD12 ' A' ' 41' ' ' LEU . 23.4 mp0 -69.24 -19.19 63.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.025 -0.534 . . . . 13.68 111.839 -179.174 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.481 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 36.7 mt-10 -73.45 -24.05 60.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.945 0.402 . . . . 17.34 110.426 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.581 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.8 mm? -93.45 -28.49 16.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.071 -0.513 . . . . 13.56 110.286 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 91.8 mt -61.17 131.8 51.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.925 -0.579 . . . . 13.42 110.772 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 75.99 11.72 84.54 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.928 -0.653 . . . . 13.390000000000001 112.681 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.762 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 7.9 mmpt? -129.47 159.61 35.74 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.696 0.284 . . . . 17.239999999999998 110.388 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -94.02 138.23 32.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.157 -0.474 . . . . 12.77 110.197 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 17.2 tt -60.25 -25.7 34.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.013 -0.539 . . . . 12.050000000000001 111.3 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.8 p -68.38 -20.84 25.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 116.342 -0.39 . . . . 13.390000000000001 111.413 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -76.99 -23.62 52.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.048 0.451 . . . . 16.530000000000001 110.4 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -106.11 15.09 26.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.885 -0.598 . . . . 15.83 109.984 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 17.1 t -106.62 147.98 28.86 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.461 -0.79 . . . . 12.01 110.843 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 7.4 t-160 -57.76 127.76 79.19 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 115.58 -0.736 . . . . 15.130000000000001 109.36 178.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -45.18 -52.17 6.82 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.475 2.783 . . . . 15.83 113.976 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -67.67 -8.91 38.77 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.315 0.487 . . . . 16.690000000000001 112.315 -179.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.506 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 27.8 m-20 -114.84 -1.48 13.18 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.793 0.33 . . . . 13.16 110.893 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -62.39 -46.2 89.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.24 -0.436 . . . . 16.170000000000002 111.099 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -63.01 -38.19 90.19 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.64 -0.504 . . . . 14.35 109.64 178.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.3 tp -61.7 -43.35 99.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.626 -0.716 . . . . 12.51 109.925 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.438 HD21 ' HA ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -63.99 -52.52 59.2 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.781 -0.645 . . . . 10.08 110.706 179.487 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 33.6 ttt180 -58.22 -46.3 86.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.319 -0.4 . . . . 11.710000000000001 111.385 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.46 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 34.7 t70 -61.5 -45.58 93.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.71 -0.223 . . . . 9.7100000000000009 110.914 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 45.2 m -63.61 -37.53 87.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.972 0.415 . . . . 9.5199999999999996 110.557 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.493 ' O ' HG12 ' A' ' 64' ' ' VAL . 2.8 m-30 -63.3 -37.33 86.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.106 -0.497 . . . . 12.109999999999999 109.993 178.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 -73.32 -33.06 64.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.182 -0.463 . . . . 10.289999999999999 109.92 178.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.46 ' HG3' ' O ' ' A' ' 59' ' ' ASP . 52.9 mt-30 -63.53 -45.33 91.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.878 -0.601 . . . . 10.619999999999999 110.991 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.493 HG12 ' O ' ' A' ' 61' ' ' PHE . 6.3 p -65.29 -25.23 36.71 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-N 116.538 -0.301 . . . . 10.93 111.472 -179.231 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 61' ' ' PHE . 79.5 t -70.82 -32.77 50.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 109.405 -0.591 . . . . 12.890000000000001 109.405 178.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 34.8 mtpt -82.56 -18.31 41.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.43 -0.805 . . . . 16.68 110.245 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 92.1 mt -83.03 -54.16 5.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.012 -0.54 . . . . 13.18 109.967 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 57.6 mttt 61.4 94.98 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.914 0.759 . . . . 15.17 112.814 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 107.17 -25.48 21.87 Favored Glycine 0 N--CA 1.454 -0.109 0 C-N-CA 120.423 -0.894 . . . . 10.01 113.753 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -90.33 131.54 36.07 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.156 -0.313 . . . . 10.039999999999999 110.156 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.446 ' HB ' ' HZ ' ' B' ' 24' ' ' PHE . 3.7 p -77.54 113.07 16.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.269 0.557 . . . . 8.5399999999999991 110.491 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 33.3 tp -102.19 100.16 10.34 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.038 -0.528 . . . . 8.1300000000000008 110.602 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.432 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 0.0 OUTLIER -81.66 115.01 20.72 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.607 -0.724 . . . . 7.8899999999999997 110.363 179.478 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 p -109.52 122.95 64.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.915 0.388 . . . . 8.1799999999999997 110.172 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 27.7 ttt -97.17 111.96 23.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.261 -0.427 . . . . 9.6999999999999993 111.065 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.506 ' HB2' ' HB3' ' A' ' 53' ' ' ASP . 48.3 p90 -140.49 -173.47 3.69 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.195 -0.669 . . . . 10.27 109.195 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.442 ' HB3' ' HB3' ' A' ' 85' ' ' TRP . 12.9 mtm180 -105.59 122.17 45.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.105 0.479 . . . . 13.859999999999999 110.649 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -104.27 152.61 22.01 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.671 -0.695 . . . . 9.7300000000000004 110.203 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.613 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 46.9 ttp180 -92.83 128.43 38.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.871 0.367 . . . . 11.300000000000001 111.018 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.631 ' HA ' ' HB ' ' A' ' 33' ' ' VAL . 77.5 p -90.76 -176.63 4.75 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.698 -0.482 . . . . 11.039999999999999 109.698 179.117 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.422 ' HD2' ' HA ' ' A' ' 81' ' ' LYS . 40.3 tptt -71.41 -12.2 61.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.376 0.608 . . . . 13.18 109.614 178.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -90.84 2.98 55.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.404 -0.816 . . . . 14.890000000000001 109.342 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 65.24 23.72 12.22 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 115.029 -0.987 . . . . 12.92 111.104 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.486 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.6 pt-20 -99.2 160.15 14.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 10.94 109.888 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.613 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 64.8 m95 -106.47 110.66 22.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.521 -0.309 . . . . 11.77 110.638 -179.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -113.72 154.94 26.47 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.264 -0.426 . . . . 11.57 110.072 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.442 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 97.9 m95 -75.04 120.5 20.65 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.247 0.546 . . . . 10.73 111.416 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 47.8 tpp -119.44 130.71 55.4 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.221 -0.9 . . . . 9.7400000000000002 110.416 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.493 ' HB3' ' HB ' ' A' ' 111' ' ' THR . 3.1 ttp180 -101.87 73.97 1.44 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.042 -0.725 . . . . 11.16 109.042 178.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.629 HG22 ' HB3' ' A' ' 108' ' ' CYS . 52.3 m -64.34 114.43 4.27 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.694 -0.685 . . . . 9.5899999999999999 111.651 -179.242 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.58 ' O ' ' HA ' ' A' ' 108' ' ' CYS . 0.7 OUTLIER -89.75 94.45 9.84 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.385 -0.825 . . . . 8.8800000000000008 109.873 179.948 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.434 ' HA ' ' SG ' ' A' ' 108' ' ' CYS . 5.3 m -77.5 117.45 18.96 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.982 0.42 . . . . 8.9399999999999995 111.532 -179.057 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -122.91 117.55 25.82 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.837 -0.619 . . . . 12.1 109.77 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.56 127.75 33.6 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.227 -0.442 . . . . 10.16 111.664 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -104.03 118.53 36.89 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.586 -0.524 . . . . 12.6 109.586 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -108.54 149.17 29.22 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.215 0.531 . . . . 14.6 111.928 -178.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.455 ' HA ' ' HD3' ' A' ' 98' ' ' PRO . 12.0 t-20 -97.19 132.89 24.75 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 115.36 -0.836 . . . . 13.83 109.612 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 97' ' ' ASN . 27.5 Cg_exo -63.27 -6.31 9.74 Favored 'Trans proline' 0 N--CA 1.476 0.486 0 C-N-CA 123.358 2.705 . . . . 15.34 114.467 -178.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -62.84 -61.51 2.36 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.643 0.258 . . . . 16.890000000000001 110.436 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -145.31 27.95 1.23 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.736 0.303 . . . . 15.140000000000001 111.0 179.096 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 27.7 t70 63.52 41.9 7.0 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.529 -0.759 . . . . 14.94 111.782 179.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -91.36 142.47 27.65 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.351 -0.386 . . . . 12.949999999999999 110.067 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 48.9 mt -88.75 102.3 12.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.047 -0.353 . . . . 11.44 110.047 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -71.26 -41.37 70.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.71 0.291 . . . . 11.65 110.974 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.428 ' HB2' ' O ' ' A' ' 16' ' ' HIS . 20.6 p90 -161.6 178.96 8.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.777 0.322 . . . . 10.35 110.642 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 44.4 mt -122.24 123.24 68.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.092 -0.504 . . . . 10.470000000000001 110.634 -179.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.574 HG23 HH22 ' B' ' 15' ' ' ARG . 85.8 mt -91.12 112.7 25.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.11 -0.7 . . . . 9.3200000000000003 109.11 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.629 ' HB3' HG22 ' A' ' 90' ' ' THR . 96.8 m -113.76 116.59 29.63 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.372 0.508 . . . . 10.15 112.372 -178.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.539 HG23 HG13 ' B' ' 13' ' ' ILE . 0.2 OUTLIER -82.92 110.55 18.0 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.69 -0.856 . . . . 11.4 108.69 177.865 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.622 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 3.9 m-20 -85.56 98.33 10.58 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.882 0.372 . . . . 11.640000000000001 111.448 -178.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' THR . . . . . 0.493 ' HB ' ' HB3' ' A' ' 89' ' ' ARG . 1.3 m -93.75 110.55 22.18 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.756 -0.657 . . . . 11.220000000000001 111.165 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . 0.791 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 3.8 t-20 -75.64 111.93 11.48 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.588 -0.523 . . . . 12.98 109.588 178.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . 0.467 HG11 ' HG3' ' A' ' 114' ' ' LYS . 39.5 t -91.4 -53.41 8.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 116.072 -0.513 . . . . 15.109999999999999 110.488 -179.578 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.467 ' HG3' HG11 ' A' ' 113' ' ' VAL . 54.7 mtpt . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.406 -0.806 . . . . 16.32 110.056 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 18.8 m . . . . . 0 N--CA 1.478 0.96 0 CA-C-O 120.716 0.294 . . . . 7.8399999999999999 110.295 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' GLN . . . . . 0.738 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 33.5 mm-40 -75.81 146.18 79.24 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.386 -0.37 . . . . 7.4900000000000002 110.94 -179.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' B' ' 8' ' ' GLN . 5.5 Cg_exo -80.54 -167.41 0.5 Allowed 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 123.276 2.651 . . . . 6.4400000000000004 112.812 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' THR . . . . . 0.715 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.1 OUTLIER -99.32 47.04 0.96 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.218 0.532 . . . . 5.9800000000000004 110.936 -179.707 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.508 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -151.76 151.53 31.51 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.543 -0.91 . . . . 5.8499999999999996 108.543 179.593 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' PHE . . . . . 0.609 ' HB2' ' HB3' ' B' ' 26' ' ' ASP . 18.8 p90 -161.32 158.72 27.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.412 0.625 . . . . 6.4900000000000002 112.019 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . 0.539 HG13 HG23 ' A' ' 109' ' ' THR . 24.7 mm -85.51 118.81 32.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.091 -0.959 . . . . 6.0199999999999996 110.542 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.424 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.8 OUTLIER -112.79 89.2 3.01 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.199 -0.455 . . . . 5.3700000000000001 110.761 179.9 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . 0.574 HH22 HG23 ' A' ' 107' ' ' ILE . 8.1 mtp180 -83.4 110.83 18.48 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.387 -0.597 . . . . 9.4600000000000009 109.387 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . 0.494 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 33.6 p80 -136.68 162.53 32.9 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.548 -0.296 . . . . 8.3100000000000005 110.616 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -78.14 174.97 10.59 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.208 -0.293 . . . . 11.19 110.208 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 27.0 pt -59.71 -24.11 28.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 113.109 0.781 . . . . 9.3699999999999992 113.109 -178.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -77.54 -22.01 51.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.935 0.398 . . . . 11.92 110.981 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 112.72 -7.82 25.94 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.558 -0.83 . . . . 8.6799999999999997 112.368 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 33.9 mm -69.71 116.71 11.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 110.186 -0.301 . . . . 11.16 110.186 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . 0.494 ' HA ' ' HB3' ' B' ' 16' ' ' HIS . 94.7 m-85 -66.13 121.4 15.07 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.091 -0.504 . . . . 8.5999999999999996 111.106 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -92.19 -40.25 11.11 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.779 -0.646 . . . . 7.9100000000000001 110.363 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . 0.446 ' HZ ' ' HB ' ' A' ' 71' ' ' VAL . 47.6 t80 -155.44 120.87 4.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.101 -0.499 . . . . 8.5 110.29 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 10.6 m -115.86 154.68 17.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.032 0.444 . . . . 6.5 111.218 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . 0.609 ' HB3' ' HB2' ' B' ' 12' ' ' PHE . 9.2 t70 -74.47 165.03 25.88 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.428 -0.806 . . . . 7.1500000000000004 110.233 179.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 4.2 m170 -82.27 -8.7 59.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.838 0.352 . . . . 9.4100000000000001 110.981 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . 0.738 ' HG2' ' HB3' ' B' ' 8' ' ' GLN . 72.1 mtm180 -69.1 -14.62 63.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.006 -0.543 . . . . 9.7599999999999998 111.974 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 28.4 p -57.28 -31.66 65.84 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 111.725 0.269 . . . . 11.56 111.725 -178.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 25.1 t -63.05 -38.74 82.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.205 -0.452 . . . . 14.01 111.108 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.04 -17.57 30.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.771 0.32 . . . . 12.9 110.968 179.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 41.5 m -80.39 -58.82 2.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.167 -0.47 . . . . 12.34 111.849 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' VAL . . . . . 0.484 ' HB ' ' HA ' ' B' ' 80' ' ' SER . 3.5 m -127.68 -2.07 3.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 112.24 0.459 . . . . 13.869999999999999 112.24 -178.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.29 -19.94 28.85 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.705 -0.759 . . . . 14.369999999999999 112.564 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' TYR . . . . . 0.448 ' HB2' HG22 ' B' ' 33' ' ' VAL . 4.2 m-85 -62.95 129.63 41.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.708 0.29 . . . . 15.56 110.668 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . 0.575 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 40.4 mm-40 -73.74 151.89 89.1 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 109.54 -0.541 . . . . 13.859999999999999 109.54 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.494 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 61.3 Cg_exo -51.58 -38.86 65.85 Favored 'Trans proline' 0 CA--C 1.53 0.32 0 C-N-CA 122.757 2.304 . . . . 15.210000000000001 112.778 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 24.3 mp0 -71.44 -13.38 61.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.883 -0.599 . . . . 17.82 111.821 -179.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.575 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 30.4 mt-10 -85.14 -19.8 31.24 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.8 0.333 . . . . 14.42 110.293 179.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -92.24 -45.1 8.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.016 -0.538 . . . . 14.550000000000001 110.377 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 51.5 mt -58.56 126.39 27.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.009 -0.541 . . . . 14.050000000000001 111.211 -179.249 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.53 -5.16 83.99 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.778 -0.646 . . . . 11.68 112.261 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.797 ' HA ' ' HE2' ' B' ' 43' ' ' LYS . 6.7 mmpt? -112.05 160.05 17.87 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 122.758 -0.26 . . . . 14.17 110.433 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' ASN . . . . . 0.806 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 17.7 m120 -92.61 138.12 31.78 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.601 -0.518 . . . . 10.74 109.601 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . 0.424 ' HB ' ' CZ ' ' B' ' 22' ' ' PHE . 14.4 tt -62.9 -28.07 44.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.034 0.445 . . . . 9.8800000000000008 111.055 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 5.1 p -71.5 -18.64 20.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-N 116.224 -0.444 . . . . 11.779999999999999 111.72 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . 0.806 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 42.9 mt-10 -69.57 -37.41 76.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.902 0.382 . . . . 11.890000000000001 110.968 -179.344 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 -98.74 18.19 17.53 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.023 0.439 . . . . 14.279999999999999 110.405 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 41.1 t -101.65 145.67 28.77 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.888 -0.596 . . . . 10.81 110.616 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' HIS . . . . . 0.466 ' CD2' ' HD2' ' B' ' 51' ' ' PRO . 5.5 t-160 -55.64 128.61 69.32 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.537 -0.756 . . . . 12.029999999999999 109.92 178.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' PRO . . . . . 0.466 ' HD2' ' CD2' ' B' ' 50' ' ' HIS . 95.7 Cg_exo -44.57 -51.72 6.81 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 123.516 2.811 . . . . 11.869999999999999 113.628 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -70.07 -4.19 19.98 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.184 0.439 . . . . 9.2799999999999994 112.184 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 -120.54 -0.32 10.32 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.866 0.365 . . . . 7.5199999999999996 110.502 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -62.72 -43.51 98.62 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.97 -0.559 . . . . 6.5700000000000003 111.209 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 48.6 tp60 -69.41 -39.31 77.97 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.425 -0.352 . . . . 6.9900000000000002 110.189 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 58.0 tp -59.64 -39.81 85.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 5.1399999999999997 110.483 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . 0.428 HD22 ' CZ ' ' B' ' 61' ' ' PHE . 0.7 OUTLIER -62.85 -50.42 71.0 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.003 -0.544 . . . . 6.8200000000000003 110.33 179.267 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 52.8 ttt180 -61.43 -43.45 98.85 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.103 -0.499 . . . . 8.6899999999999995 110.923 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . 0.429 ' O ' ' HG3' ' B' ' 63' ' ' GLN . 25.3 t70 -60.0 -46.52 89.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.812 0.339 . . . . 6.46 110.296 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 36.6 m -61.42 -34.2 74.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.959 -0.564 . . . . 5.5899999999999999 110.426 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 61' ' ' PHE . . . . . 0.508 ' O ' HG23 ' B' ' 65' ' ' VAL . 10.7 m-85 -65.35 -39.8 92.82 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.295 0.569 . . . . 8.3300000000000001 109.535 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -67.4 -35.55 79.52 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.802 -0.636 . . . . 7.1500000000000004 110.171 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.429 ' HG3' ' O ' ' B' ' 59' ' ' ASP . 34.8 mt-30 -69.28 -44.51 71.69 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.941 -0.572 . . . . 9.5299999999999994 111.514 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.544 ' HA ' HD12 ' B' ' 67' ' ' LEU . 9.9 p -63.49 -29.22 46.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-O 120.719 0.295 . . . . 8.2200000000000006 110.692 -179.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . 0.666 ' HA ' HG21 ' B' ' 94' ' ' THR . 61.3 t -70.44 -35.48 62.24 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.1 0 N-CA-C 109.638 -0.505 . . . . 7.4299999999999997 109.638 178.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -67.66 -39.97 84.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.843 -0.617 . . . . 10.52 110.039 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.544 HD12 ' HA ' ' B' ' 64' ' ' VAL . 25.6 mt -66.17 -49.0 68.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.564 -0.744 . . . . 7.5300000000000002 110.082 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 14.6 tttt 60.75 98.41 0.03 OUTLIER 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.474 -0.785 . . . . 8.0099999999999998 112.228 179.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.83 20.36 34.16 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.751 -0.738 . . . . 5.8700000000000001 112.427 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -124.89 154.06 41.67 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.569 -0.53 . . . . 5.6299999999999999 109.569 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 71' ' ' VAL . . . . . 0.575 ' CG2' ' HB3' ' B' ' 91' ' ' SER . 2.7 p -103.96 117.36 49.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-O 121.283 0.564 . . . . 6.0599999999999996 110.582 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 13.0 tp -108.86 111.05 22.56 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.773 -0.649 . . . . 4.9299999999999997 110.09 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 73' ' ' SER . . . . . 0.582 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 12.7 m -87.06 112.18 21.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.233 -0.44 . . . . 6.79 111.117 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.2 p -108.82 131.19 60.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.039 -0.528 . . . . 4.4199999999999999 110.061 179.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 25.4 ttt -100.85 115.11 29.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.077 0.465 . . . . 5.6699999999999999 110.912 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.496 ' HE1' ' HB ' ' B' ' 90' ' ' THR . 50.7 p90 -143.99 178.17 8.04 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.649 -0.705 . . . . 3.75 109.456 179.662 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 77' ' ' ARG . . . . . 0.543 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 12.1 mtm180 -101.09 122.23 43.21 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.998 0.428 . . . . 7.3499999999999996 110.112 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . 0.431 ' HD1' ' HE2' ' B' ' 76' ' ' PHE . 25.5 t80 -105.78 145.81 30.68 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.604 -0.726 . . . . 5.79 110.119 -179.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 79' ' ' ARG . . . . . 0.533 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 30.4 ttt180 -87.22 122.35 30.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.141 -0.481 . . . . 11.529999999999999 110.782 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 80' ' ' SER . . . . . 0.484 ' HA ' ' HB ' ' B' ' 33' ' ' VAL . 76.5 p -86.37 -176.81 6.03 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.085 -0.507 . . . . 7.4699999999999998 109.746 179.028 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -70.63 -13.06 61.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.496 0.665 . . . . 12.67 109.581 178.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -88.61 0.03 56.79 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.595 -0.73 . . . . 9.25 109.626 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 69.76 20.19 6.93 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.393 -0.821 . . . . 8.75 110.832 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . 0.423 ' O ' ' HA ' ' B' ' 79' ' ' ARG . 2.8 pt-20 -98.94 151.4 20.93 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.348 -0.387 . . . . 6.8700000000000001 110.118 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . 0.543 ' HB3' ' HB3' ' B' ' 77' ' ' ARG . 44.2 m95 -100.76 103.2 14.43 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.246 -0.434 . . . . 8.3800000000000008 110.587 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . 0.405 ' O ' ' HA ' ' B' ' 77' ' ' ARG . 0.8 OUTLIER -103.46 151.84 22.35 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.221 -0.445 . . . . 7.25 110.346 179.642 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 87' ' ' TRP . . . . . 0.688 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 89.7 m95 -76.37 114.4 15.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.246 0.546 . . . . 9.3000000000000007 110.759 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 88' ' ' MET . . . . . 0.417 ' HE1' ' HB2' ' B' ' 88' ' ' MET . 21.4 tpp -115.21 129.89 56.77 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.216 -0.902 . . . . 4.46 110.792 -178.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 -99.49 85.07 3.08 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.566 -0.901 . . . . 7.3099999999999996 108.566 178.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 90' ' ' THR . . . . . 0.496 ' HB ' ' HE1' ' B' ' 76' ' ' PHE . 22.7 m -78.82 113.19 16.7 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.759 -0.655 . . . . 6.1799999999999997 111.86 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 91' ' ' SER . . . . . 0.613 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 20.3 m -93.66 87.7 5.58 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.63 -0.714 . . . . 6.4500000000000002 109.815 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 92' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' B' ' 108' ' ' CYS . 14.4 m -72.74 128.75 36.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.903 -0.59 . . . . 6.75 111.419 -178.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -122.71 126.41 47.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.106 -0.497 . . . . 6.4500000000000002 110.021 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 94' ' ' THR . . . . . 0.666 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.1 OUTLIER -83.3 107.7 16.01 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.709 0.29 . . . . 9.8800000000000008 110.501 179.406 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 95' ' ' PHE . . . . . 0.458 ' HE1' ' HE2' ' A' ' 24' ' ' PHE . 0.3 OUTLIER -86.27 129.73 34.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.381 -0.372 . . . . 8.9100000000000001 110.558 -179.466 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -108.48 131.51 54.74 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.011 -0.54 . . . . 10.99 111.028 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 97' ' ' ASN . . . . . 0.434 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 55.9 t30 -71.49 127.9 90.59 Favored Pre-proline 0 C--N 1.32 -0.706 0 N-CA-C 108.866 -0.79 . . . . 8.5099999999999998 108.866 178.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 98' ' ' PRO . . . . . 0.434 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 57.4 Cg_endo -70.37 45.39 0.52 Allowed 'Trans proline' 0 CA--C 1.534 0.501 0 C-N-CA 123.175 2.583 . . . . 9.1600000000000001 113.137 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -126.53 -54.22 1.45 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.44 -0.345 . . . . 11.390000000000001 110.702 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 48.5 m -137.11 21.43 3.01 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.745 -0.207 . . . . 7.9000000000000004 111.201 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 25.4 t70 64.8 20.2 12.06 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 121.525 0.679 . . . . 9.0800000000000001 110.492 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 4.3 pm0 -79.95 142.51 35.01 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.083 -0.508 . . . . 7.71 110.477 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 80.8 mt -76.53 110.86 12.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.751 -0.463 . . . . 8.3800000000000008 109.751 179.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -73.04 -45.09 59.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.555 -0.293 . . . . 8.8100000000000005 110.468 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -168.56 165.61 12.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.939 0.4 . . . . 7.8200000000000003 110.758 179.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 32.7 mt -101.36 113.52 37.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.883 -0.599 . . . . 7.2199999999999998 109.667 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . 0.51 HG12 ' HG2' ' B' ' 15' ' ' ARG . 64.2 mt -88.72 100.33 10.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.917 -0.583 . . . . 6.7199999999999998 110.005 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 108' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' B' ' 92' ' ' SER . 54.0 m -88.38 106.87 18.53 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.106 0.479 . . . . 5.3099999999999996 111.204 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 109' ' ' THR . . . . . 0.613 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 0.4 OUTLIER -81.39 87.03 6.19 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.273 -0.64 . . . . 5.8700000000000001 109.273 178.576 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 110' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -69.61 141.47 53.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.692 -0.686 . . . . 6.9000000000000004 110.6 -178.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 2.6 m -149.47 113.53 5.16 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.107 -0.331 . . . . 8.9000000000000004 110.107 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 112' ' ' ASN . . . . . 0.715 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 17.7 t-20 -70.08 133.38 47.11 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.195 0.521 . . . . 11.84 110.987 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 113' ' ' VAL . . . . . 0.466 HG11 ' HG3' ' B' ' 114' ' ' LYS . 66.2 t -113.6 -51.25 5.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.557 -0.747 . . . . 12.4 109.359 179.138 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . 0.688 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 61.0 mtpt . . . . . 0 C--O 1.246 0.871 0 CA-C-O 118.369 -0.825 . . . . 12.68 109.609 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 . . . . . 0 N--CA 1.451 -0.417 0 N-CA-C 109.836 -0.431 . . . . 15.44 109.836 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.8 154.49 58.83 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.598 2.198 . . . . 14.109999999999999 112.164 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' THR . . . . . 0.824 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.7 OUTLIER -79.92 56.09 2.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.493 0.663 . . . . 11.369999999999999 110.516 179.593 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.504 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 15.6 tt0 -157.12 117.78 3.58 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.058 -0.974 . . . . 10.59 108.939 -178.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.85 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 35.7 p90 -140.77 162.14 36.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.365 0.602 . . . . 9.1999999999999993 112.191 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.44 HG21 HG21 ' A' ' 107' ' ' ILE . 42.8 mm -93.99 124.93 46.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.467 -0.788 . . . . 8.9399999999999995 110.802 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.57 ' HB3' ' HE1' ' A' ' 22' ' ' PHE . 2.4 m -115.14 105.77 13.31 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.27 -0.423 . . . . 6.1100000000000003 110.934 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -89.97 112.58 24.03 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.278 -0.638 . . . . 9.4600000000000009 109.278 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.2 p80 -139.22 159.9 41.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.474 0.178 . . . . 10.369999999999999 110.991 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -77.98 174.9 10.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.443 -0.344 . . . . 13.279999999999999 110.226 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 14.9 pt -57.32 -27.92 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 N-CA-C 113.236 0.828 . . . . 13.970000000000001 113.236 -178.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -80.44 -17.91 50.33 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.107 0.48 . . . . 13.85 111.453 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 110.11 0.1 29.94 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.506 -0.854 . . . . 9.6099999999999994 112.793 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ILE . . . . . 0.48 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 30.9 mm -72.73 118.42 17.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.719 -0.474 . . . . 11.289999999999999 109.719 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.57 ' HE1' ' HB3' ' A' ' 14' ' ' SER . 90.1 m-85 -72.07 124.91 25.96 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.059 0.457 . . . . 10.449999999999999 111.924 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -97.39 -29.2 13.64 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.365 -0.834 . . . . 8.1300000000000008 110.078 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -158.27 125.54 5.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.714 -0.676 . . . . 7.4900000000000002 110.01 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.454 HG21 ' HB2' ' A' ' 40' ' ' LEU . 9.5 t -118.96 134.82 61.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.407 -0.36 . . . . 6.4500000000000002 111.006 -179.376 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.85 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 9.7 t70 -66.26 139.41 58.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.011 -0.54 . . . . 7.3099999999999996 109.771 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -62.77 -14.23 42.51 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.332 0.493 . . . . 12.41 112.332 -179.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 79.7 mtm180 -69.04 -10.97 60.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.675 0.274 . . . . 12.19 111.282 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 27.8 p -60.6 -31.98 71.12 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.765 0.317 . . . . 13.5 110.515 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.559 HG12 HE22 ' A' ' 36' ' ' GLN . 42.5 t -62.04 -35.3 67.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.77 -0.65 . . . . 16.559999999999999 111.296 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -91.25 -8.1 49.35 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.825 0.345 . . . . 15.07 111.69 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.7 ' HA ' HG21 ' A' ' 10' ' ' THR . 24.7 m -97.13 -55.23 2.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.856 0.36 . . . . 15.26 111.322 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 2.9 m -117.18 -13.61 10.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.405 -0.361 . . . . 14.18 111.741 -179.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.426 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 92.11 -15.15 62.67 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.603 -0.808 . . . . 13.85 112.524 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -75.01 139.01 42.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.564 0.221 . . . . 18.59 110.662 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.559 HE22 HG12 ' A' ' 30' ' ' VAL . 33.9 mm-40 -80.59 149.8 68.8 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.394 -0.595 . . . . 15.890000000000001 109.394 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.583 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 51.2 Cg_exo -54.8 -37.41 92.27 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.411 2.074 . . . . 12.26 112.388 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.465 ' HA ' HD12 ' A' ' 41' ' ' LEU . 15.5 mp0 -69.77 -19.07 63.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.125 -0.489 . . . . 13.68 111.347 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.533 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 47.1 mt-10 -82.11 -14.33 55.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.971 0.415 . . . . 17.34 110.37 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.454 ' HB2' HG21 ' A' ' 25' ' ' VAL . 3.2 mm? -101.07 -27.31 13.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.866 -0.606 . . . . 13.56 110.301 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 95.1 mt -60.64 125.54 24.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.947 -0.569 . . . . 13.42 110.673 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 81.54 2.71 90.62 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.872 -0.68 . . . . 13.390000000000001 112.366 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.716 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 9.1 mmpt? -111.69 160.49 17.22 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.776 0.322 . . . . 17.239999999999998 110.647 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.652 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 16.0 m120 -96.48 135.58 38.16 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.041 -0.527 . . . . 12.77 109.698 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.54 HG13 ' HE1' ' A' ' 78' ' ' PHE . 10.6 tt -59.53 -26.09 33.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.18 0.514 . . . . 12.050000000000001 110.947 179.176 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.495 HG12 ' HB3' ' A' ' 44' ' ' ASN . 9.9 p -69.93 -22.18 24.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 115.716 -0.675 . . . . 13.390000000000001 111.424 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.652 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.5 mt-10 -70.05 -36.06 74.72 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.303 0.573 . . . . 16.530000000000001 110.731 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -101.69 34.74 2.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.769 -0.65 . . . . 15.83 110.443 -179.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 36.0 t -120.9 150.25 41.36 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.623 -0.717 . . . . 12.01 110.296 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' HIS . . . . . 0.408 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 7.9 t-160 -58.64 126.23 79.16 Favored Pre-proline 0 C--N 1.329 -0.312 0 N-CA-C 109.147 -0.686 . . . . 15.130000000000001 109.147 178.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -44.51 -48.97 9.61 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 123.348 2.699 . . . . 15.83 114.17 -178.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -73.75 -4.5 34.98 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.36 0.504 . . . . 16.690000000000001 112.36 -179.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.41 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 9.3 m-20 -115.37 -2.13 12.7 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.947 0.403 . . . . 13.16 111.133 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -63.11 -41.0 99.25 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.92 -0.582 . . . . 16.170000000000002 111.156 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.1 tp60 -64.61 -43.33 94.09 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.732 -0.469 . . . . 14.35 109.732 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.8 tp -59.73 -39.34 84.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.756 -0.656 . . . . 12.51 110.139 178.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.46 HD21 ' HA ' ' A' ' 57' ' ' LEU . 0.4 OUTLIER -62.91 -51.31 67.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.842 -0.617 . . . . 10.08 110.402 179.421 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.413 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 62.0 ttt180 -63.25 -43.13 98.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.074 -0.512 . . . . 11.710000000000001 110.756 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.449 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 33.6 t70 -59.02 -47.98 83.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.273 -0.421 . . . . 9.7100000000000009 110.475 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.6 m -62.63 -34.96 78.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.967 -0.56 . . . . 9.5199999999999996 110.524 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.593 ' O ' HG12 ' A' ' 64' ' ' VAL . 3.5 m-30 -63.96 -42.18 97.35 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.872 -0.418 . . . . 12.109999999999999 109.872 178.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 58' ' ' ARG . 18.0 mm100 -67.98 -32.73 73.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.305 -0.407 . . . . 10.289999999999999 110.12 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.449 ' HG3' ' O ' ' A' ' 59' ' ' ASP . 39.2 mt-30 -70.73 -38.52 73.58 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.095 -0.502 . . . . 10.619999999999999 111.035 179.647 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.593 HG12 ' O ' ' A' ' 61' ' ' PHE . 2.7 p -67.42 -25.84 34.38 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 CA-C-O 120.857 0.36 . . . . 10.93 110.519 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 61' ' ' PHE . 89.7 t -74.94 -21.81 16.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 N-CA-C 108.89 -0.782 . . . . 12.890000000000001 108.89 178.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.7 mtpt -86.07 -32.62 21.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.393 -0.821 . . . . 16.68 109.489 178.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.806 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 82.0 mt -69.06 -54.87 12.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.586 -0.733 . . . . 13.18 110.538 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 95.1 mttt 59.67 97.59 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.977 0.798 . . . . 15.17 112.325 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.28 -12.38 68.11 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.647 -0.787 . . . . 10.01 112.235 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.806 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 6.7 tp-100 -99.2 137.22 38.02 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.322 -0.621 . . . . 10.039999999999999 109.322 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . 0.464 ' HB ' ' HZ ' ' B' ' 24' ' ' PHE . 3.9 p -88.88 121.93 39.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.3 0.572 . . . . 8.5399999999999991 110.792 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 41.0 tp -109.45 115.49 30.05 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.699 -0.682 . . . . 8.1300000000000008 109.734 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.3 m -92.46 104.17 16.52 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.113 -0.494 . . . . 7.8899999999999997 111.031 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.46 HG12 ' HB ' ' A' ' 90' ' ' THR . 2.4 p -96.98 125.29 50.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.017 -0.538 . . . . 8.1799999999999997 109.803 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 18.5 ttt -100.98 115.43 30.46 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.995 0.426 . . . . 9.6999999999999993 111.025 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.41 ' HB2' ' HB3' ' A' ' 53' ' ' ASP . 40.6 p90 -146.28 -172.69 4.0 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.478 -0.783 . . . . 10.27 109.116 179.367 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.632 ' HB3' ' HB3' ' A' ' 85' ' ' TRP . 55.9 mtm180 -108.97 118.27 36.36 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.164 0.507 . . . . 13.859999999999999 110.833 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.54 ' HE1' HG13 ' A' ' 45' ' ' ILE . 18.2 t80 -96.71 149.63 21.59 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.4 -0.818 . . . . 9.7300000000000004 110.407 -179.18 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.606 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 17.1 ttt180 -87.0 121.56 29.64 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.163 -0.471 . . . . 11.300000000000001 111.133 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.45 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 60.4 p -88.25 178.63 6.55 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.156 -0.474 . . . . 11.039999999999999 110.201 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -70.62 -13.53 62.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.272 0.558 . . . . 13.18 109.934 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -89.97 2.56 54.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.532 -0.758 . . . . 14.890000000000001 109.624 179.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 67.34 31.98 6.16 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.415 -0.811 . . . . 12.92 111.046 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.511 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 4.1 pt-20 -108.09 171.47 7.39 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.326 -0.62 . . . . 10.94 109.326 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' TRP . . . . . 0.632 ' HB3' ' HB3' ' A' ' 77' ' ' ARG . 23.7 m95 -120.41 98.57 6.11 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.079 -0.341 . . . . 11.77 110.079 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.418 ' O ' ' HA ' ' A' ' 77' ' ' ARG . 1.1 pp -96.8 151.93 19.17 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.334 -0.393 . . . . 11.57 110.886 -179.435 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.538 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 95.5 m95 -73.93 116.54 14.67 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.257 0.551 . . . . 10.73 110.66 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 36.2 tpp -116.54 131.76 56.86 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.397 -0.82 . . . . 9.7400000000000002 110.79 -179.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.2 ttp180 -100.87 70.14 1.37 Allowed 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.326 -0.99 . . . . 11.16 108.326 178.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.46 ' HB ' HG12 ' A' ' 74' ' ' VAL . 41.7 m -60.78 107.34 0.68 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.58 -0.736 . . . . 9.5899999999999999 112.27 -178.328 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' SER . . . . . 0.504 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 0.7 OUTLIER -86.52 88.92 7.74 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.11 -0.95 . . . . 8.8800000000000008 109.719 179.407 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 18.7 m -77.92 126.43 30.83 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.135 -0.484 . . . . 8.9399999999999995 111.369 -179.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -131.12 117.23 18.79 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.864 -0.607 . . . . 12.1 109.887 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.93 118.73 16.23 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.298 -0.41 . . . . 10.16 110.729 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -91.86 119.8 31.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.018 0.437 . . . . 12.6 110.619 -179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.46 ' HG2' HG12 ' A' ' 103' ' ' ILE . 34.0 mt-30 -124.15 167.51 14.16 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.75 -0.659 . . . . 14.6 110.003 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.423 ' C ' ' H ' ' A' ' 99' ' ' TYR . 64.1 m-80 -115.89 172.87 3.36 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 109.381 -0.6 . . . . 13.83 109.381 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . 0.414 ' CD ' ' HB3' ' A' ' 97' ' ' ASN . 6.8 Cg_exo -75.69 28.87 0.38 Allowed 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.522 2.148 . . . . 15.34 112.308 178.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' TYR . . . . . 0.423 ' H ' ' C ' ' A' ' 97' ' ' ASN . 62.4 m-85 -92.87 -160.6 0.76 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.325 -0.398 . . . . 16.890000000000001 110.818 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.409 ' H ' ' HB3' ' A' ' 99' ' ' TYR . 1.2 m -83.26 65.19 8.15 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.613 0.598 . . . . 15.140000000000001 112.613 -178.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 41.0 t0 51.01 76.18 0.17 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.646 -0.707 . . . . 14.94 112.45 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.31 165.57 20.29 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.844 -0.617 . . . . 12.949999999999999 109.884 179.138 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.46 HG12 ' HG2' ' A' ' 96' ' ' GLN . 80.1 mt -136.86 120.83 23.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 110.218 -0.289 . . . . 11.44 110.218 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -81.16 -44.55 17.71 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.614 -0.434 . . . . 11.65 110.469 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -165.46 178.18 6.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.481 -0.327 . . . . 10.35 110.52 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 40.8 mt -115.57 122.95 70.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.078 -0.51 . . . . 10.470000000000001 110.224 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.654 HG23 HH22 ' B' ' 15' ' ' ARG . 61.8 mt -93.21 114.84 30.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.13 -0.486 . . . . 9.3200000000000003 109.863 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 79.5 m -108.77 119.47 39.62 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.119 0.485 . . . . 10.15 111.423 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.504 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 2.6 m -88.16 101.01 13.4 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.643 -0.873 . . . . 11.4 108.643 178.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . 0.504 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 42.6 m-20 -79.23 104.32 9.77 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.232 -0.44 . . . . 11.640000000000001 111.547 -178.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 5.6 m -104.18 118.83 37.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.623 -0.717 . . . . 11.220000000000001 110.515 179.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . 0.824 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 3.5 t-20 -80.82 117.9 21.87 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.015 0.435 . . . . 12.98 110.299 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 18.9 t -97.77 -54.62 6.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.864 -0.607 . . . . 15.109999999999999 109.776 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.538 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 48.9 mtpt . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.224 -0.893 . . . . 16.32 109.52 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 71.5 m . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 110.108 -0.33 . . . . 7.8399999999999999 110.108 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' GLN . . . . . 0.93 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 93.0 mm-40 -112.85 150.42 42.79 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 116.529 -0.305 . . . . 7.4900000000000002 110.828 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.2 174.32 12.67 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 123.015 2.476 . . . . 6.4400000000000004 113.131 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' THR . . . . . 0.487 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.0 OUTLIER -83.56 58.51 4.61 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 116.001 -0.545 . . . . 5.9800000000000004 111.536 -179.86 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . 0.592 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 7.7 pt-20 -166.42 136.42 3.24 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.173 -0.677 . . . . 5.8499999999999996 109.173 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -146.12 156.61 43.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.331 0.586 . . . . 6.4900000000000002 112.005 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . 0.482 HG22 ' HG3' ' B' ' 15' ' ' ARG . 28.0 mm -86.08 119.13 33.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.359 -0.837 . . . . 6.0199999999999996 110.264 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.781 ' HB3' ' HE2' ' B' ' 22' ' ' PHE . 1.2 m -107.13 92.12 3.95 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.963 -0.562 . . . . 5.3700000000000001 110.507 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' ARG . . . . . 0.654 HH22 HG23 ' A' ' 107' ' ' ILE . 8.5 mtp180 -85.3 102.06 13.06 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.308 -0.627 . . . . 9.4600000000000009 109.308 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 29.9 p80 -131.43 164.07 26.54 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.236 -0.438 . . . . 8.3100000000000005 110.872 -179.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -78.2 179.18 7.05 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.318 -0.401 . . . . 11.19 110.621 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 27.3 pt -56.88 -33.32 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 113.252 0.834 . . . . 9.3699999999999992 113.252 -178.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -76.13 -21.94 56.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.088 0.471 . . . . 11.92 111.382 -179.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 114.05 -4.19 23.97 Favored Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 120.665 -0.779 . . . . 8.6799999999999997 112.327 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' ILE . . . . . 0.424 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 38.7 mm -67.15 114.26 3.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.939 -0.393 . . . . 11.16 109.939 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' PHE . . . . . 0.781 ' HE2' ' HB3' ' B' ' 14' ' ' SER . 97.3 m-85 -68.48 126.32 29.27 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.168 -0.469 . . . . 8.5999999999999996 111.242 -179.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 3.9 m -100.01 -37.88 8.81 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.61 -0.723 . . . . 7.9100000000000001 110.171 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . 0.474 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 30.1 t80 -147.77 123.41 10.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.675 -0.693 . . . . 8.5 109.496 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' VAL . . . . . 0.524 HG21 ' HB2' ' B' ' 40' ' ' LEU . 14.5 t -120.46 138.87 49.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 120.884 0.374 . . . . 6.5 111.074 -179.005 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -71.15 153.55 42.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.852 -0.613 . . . . 7.1500000000000004 109.971 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 34.9 m170 -70.16 -10.82 60.0 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.806 0.299 . . . . 9.4100000000000001 111.806 -178.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . 0.93 ' HG2' ' HB3' ' B' ' 8' ' ' GLN . 72.7 mtm180 -68.08 -11.45 59.07 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 111.995 0.368 . . . . 9.7599999999999998 111.995 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 20.2 p -58.32 -38.76 77.77 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 111.861 0.319 . . . . 11.56 111.861 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 4.1 t -66.39 -31.96 55.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.338 -0.392 . . . . 14.01 111.072 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.63 -10.82 56.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.904 0.383 . . . . 12.9 111.458 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' THR . . . . . 0.429 ' HA ' HG21 ' B' ' 10' ' ' THR . 14.8 m -99.74 -59.83 1.64 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.068 -0.515 . . . . 12.34 111.978 -179.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' VAL . . . . . 0.712 HG12 HD21 ' B' ' 86' ' ' LEU . 3.3 m -116.57 -5.48 11.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 111.824 0.305 . . . . 13.869999999999999 111.824 -179.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.22 0.94 89.61 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.651 -0.785 . . . . 14.369999999999999 112.285 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -80.1 137.0 36.66 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.644 0.259 . . . . 15.56 111.054 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . 0.559 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 75.8 mm-40 -79.4 150.01 73.03 Favored Pre-proline 0 C--N 1.322 -0.63 0 N-CA-C 108.667 -0.864 . . . . 13.859999999999999 108.667 178.256 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' PRO . . . . . 0.517 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 51.6 Cg_exo -53.18 -38.5 81.26 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.613 2.208 . . . . 15.210000000000001 112.303 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -67.79 -22.2 65.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.965 -0.561 . . . . 17.82 111.408 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' GLU . . . . . 0.559 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 36.4 mt-10 -73.82 -23.12 59.62 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.655 0.264 . . . . 14.42 110.951 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.524 ' HB2' HG21 ' B' ' 25' ' ' VAL . 1.7 mm? -93.17 -34.92 13.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.895 0.379 . . . . 14.550000000000001 110.625 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 81.7 mt -58.31 119.07 6.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 14.050000000000001 111.259 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.33 5.01 76.55 Favored Glycine 0 N--CA 1.454 -0.163 0 C-N-CA 121.002 -0.618 . . . . 11.68 112.636 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.45 ' HA ' ' NZ ' ' B' ' 43' ' ' LYS . 0.5 OUTLIER -119.04 159.53 23.71 Favored 'General case' 0 C--N 1.321 -0.664 0 O-C-N 122.586 -0.361 . . . . 14.17 110.353 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' ASN . . . . . 0.652 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 12.5 m120 -95.46 140.15 30.73 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.35 -0.611 . . . . 10.74 109.35 178.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 20.8 tt -61.28 -24.63 33.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.305 0.574 . . . . 9.8800000000000008 110.542 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 9.0 p -71.84 -22.68 21.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.774 -0.648 . . . . 11.779999999999999 111.183 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' GLU . . . . . 0.652 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 40.5 mt-10 -67.07 -34.6 78.0 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.164 0.507 . . . . 11.890000000000001 110.481 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -104.08 24.67 11.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.729 -0.669 . . . . 14.279999999999999 110.433 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 49.0 t -109.19 148.78 30.38 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.832 -0.622 . . . . 10.81 110.41 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 8.1 t-160 -64.9 126.72 91.69 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.713 -0.676 . . . . 12.029999999999999 109.236 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -43.24 -48.8 7.81 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 123.534 2.823 . . . . 11.869999999999999 113.779 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -70.53 -7.91 47.34 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.135 0.42 . . . . 9.2799999999999994 112.135 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' ASP . . . . . 0.599 ' HB3' ' HB2' ' B' ' 76' ' ' PHE . 16.5 m-20 -117.57 -1.17 11.71 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.951 0.405 . . . . 7.5199999999999996 110.706 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -65.14 -49.22 70.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.969 -0.559 . . . . 6.5700000000000003 111.659 -178.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -64.96 -34.86 79.43 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.504 -0.554 . . . . 6.9900000000000002 109.504 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.3 tp -58.09 -42.92 86.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.961 -0.563 . . . . 5.1399999999999997 109.777 178.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' LEU . . . . . 0.431 HD21 ' HA ' ' B' ' 57' ' ' LEU . 0.9 OUTLIER -69.16 -48.95 60.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.94 -0.573 . . . . 6.8200000000000003 110.265 179.007 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 28.5 ttt180 -57.45 -46.32 83.75 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.875 -0.602 . . . . 8.6899999999999995 111.244 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -61.0 -41.21 96.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.227 -0.442 . . . . 6.46 110.744 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 44.6 m -64.15 -35.54 81.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.479 . . . . 5.5899999999999999 110.486 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 61' ' ' PHE . . . . . 0.522 ' O ' HG12 ' B' ' 64' ' ' VAL . 9.7 m-85 -64.18 -40.85 96.97 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.475 -0.565 . . . . 8.3300000000000001 109.475 178.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -63.15 -38.83 92.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.96 -0.564 . . . . 7.1500000000000004 109.969 178.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 63' ' ' GLN . . . . . 0.501 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 68.6 mt-30 -67.14 -47.62 70.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.688 -0.687 . . . . 9.5299999999999994 111.132 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 64' ' ' VAL . . . . . 0.522 HG12 ' O ' ' B' ' 61' ' ' PHE . 4.1 p -62.24 -30.99 50.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-N 116.387 -0.37 . . . . 8.2200000000000006 111.864 -178.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . 0.444 HG23 ' O ' ' B' ' 61' ' ' PHE . 70.9 t -68.75 -37.65 77.78 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 109.516 -0.55 . . . . 7.4299999999999997 109.516 178.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -71.57 -32.72 68.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.786 -0.643 . . . . 10.52 110.165 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' B' ' 63' ' ' GLN . 94.0 mt -67.33 -54.13 23.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.854 -0.612 . . . . 7.5300000000000002 110.365 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 23.5 mttt 63.26 113.37 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.439 -0.8 . . . . 8.0099999999999998 112.008 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 77.26 19.81 76.23 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.798 -0.715 . . . . 5.8700000000000001 112.17 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -126.01 153.5 44.3 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.937 -0.394 . . . . 5.6299999999999999 109.937 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 71' ' ' VAL . . . . . 0.504 ' CG2' ' HB3' ' B' ' 91' ' ' SER . 3.3 p -110.96 116.37 52.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-O 121.299 0.571 . . . . 6.0599999999999996 110.518 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 18.7 tp -107.95 116.56 32.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.701 -0.681 . . . . 4.9299999999999997 110.306 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 73' ' ' SER . . . . . 0.555 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 7.6 m -90.36 115.7 27.75 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.175 -0.466 . . . . 6.79 110.995 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 p -113.83 126.96 71.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 116.096 -0.502 . . . . 4.4199999999999999 110.107 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 24.7 ttt -94.83 113.79 25.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.167 0.508 . . . . 5.6699999999999999 110.563 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.599 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 48.0 p90 -137.9 -174.58 3.82 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.63 -0.714 . . . . 3.75 109.397 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 77' ' ' ARG . . . . . . . . . . . . . 9.3 mtm180 -108.3 115.19 29.66 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.99 0.424 . . . . 7.3499999999999996 110.11 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . 0.54 ' HD2' HG13 ' B' ' 33' ' ' VAL . 28.0 t80 -100.52 148.46 24.77 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.656 -0.702 . . . . 5.79 110.282 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 79' ' ' ARG . . . . . 0.523 ' HA ' ' O ' ' B' ' 84' ' ' GLU . 20.2 ttp180 -85.77 133.47 33.99 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.142 -0.481 . . . . 11.529999999999999 110.725 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 80' ' ' SER . . . . . 0.457 ' HA ' ' HB ' ' B' ' 33' ' ' VAL . 96.6 p -93.14 179.48 5.41 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.522 -0.547 . . . . 7.4699999999999998 109.522 178.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 47.3 tptt -67.89 -14.76 63.22 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.607 0.718 . . . . 12.67 109.53 178.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 40.0 m-20 -89.02 2.52 53.89 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.151 -0.931 . . . . 9.25 109.685 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 66.49 25.08 10.22 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 115.305 -0.862 . . . . 8.75 111.522 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . 0.523 ' O ' ' HA ' ' B' ' 79' ' ' ARG . 1.9 pt-20 -104.29 167.15 9.94 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.228 -0.656 . . . . 6.8700000000000001 109.228 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 85' ' ' TRP . . . . . 0.519 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 49.3 m95 -109.04 118.82 37.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.049 0.452 . . . . 8.3800000000000008 110.69 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' LEU . . . . . 0.712 HD21 HG12 ' B' ' 33' ' ' VAL . 2.1 pp -116.02 150.38 37.33 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.004 -0.544 . . . . 7.25 109.986 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 87' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -72.73 122.19 21.09 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.871 -0.418 . . . . 9.3000000000000007 109.871 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 15.0 tpp -128.35 126.6 41.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.135 -0.484 . . . . 4.46 110.96 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 30.3 ttp180 -100.19 87.58 3.49 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.292 -1.003 . . . . 7.3099999999999996 108.292 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 90' ' ' THR . . . . . 0.452 HG22 ' HB3' ' B' ' 108' ' ' CYS . 28.0 m -80.66 112.87 18.42 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.672 -0.694 . . . . 6.1799999999999997 112.309 -178.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 91' ' ' SER . . . . . 0.665 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 44.5 m -88.76 90.67 8.51 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.584 -0.734 . . . . 6.4500000000000002 109.179 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 92' ' ' SER . . . . . 0.532 ' HA ' ' HA ' ' B' ' 108' ' ' CYS . 15.6 m -78.77 122.37 25.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.235 -0.438 . . . . 6.75 111.502 -178.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -118.17 121.37 40.33 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.284 -0.417 . . . . 6.4500000000000002 110.562 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 94' ' ' THR . . . . . 0.413 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.6 OUTLIER -86.19 100.72 12.43 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.426 -0.352 . . . . 9.8800000000000008 110.189 179.051 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -76.71 126.28 30.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.988 0.423 . . . . 8.9100000000000001 111.084 -179.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -94.84 116.33 28.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.867 -0.606 . . . . 10.99 109.731 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 97' ' ' ASN . . . . . 0.4 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 51.5 t30 -65.46 126.75 92.11 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 109.544 -0.539 . . . . 8.5099999999999998 109.544 179.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 98' ' ' PRO . . . . . 0.4 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 58.2 Cg_endo -71.29 42.72 0.46 Allowed 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 123.076 2.518 . . . . 9.1600000000000001 113.693 -178.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -118.56 -61.2 1.69 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.407 -0.59 . . . . 11.390000000000001 109.407 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -135.14 22.47 3.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.638 -0.71 . . . . 7.9000000000000004 109.868 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 4.3 t70 63.42 24.59 14.21 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.549 -0.75 . . . . 9.0800000000000001 110.727 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -84.93 143.03 29.25 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.995 0.426 . . . . 7.71 110.462 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 67.1 mt -79.72 109.43 14.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.295 -0.412 . . . . 8.3800000000000008 109.896 179.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -71.6 -41.93 68.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.422 -0.353 . . . . 8.8100000000000005 110.647 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -169.89 168.63 8.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.296 -0.411 . . . . 7.8200000000000003 109.911 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 22.1 mt -103.21 118.89 50.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.106 -0.497 . . . . 7.2199999999999998 110.036 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 46.3 mt -88.62 93.19 4.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.74 -0.664 . . . . 6.7199999999999998 109.912 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 108' ' ' CYS . . . . . 0.532 ' HA ' ' HA ' ' B' ' 92' ' ' SER . 67.1 m -87.75 116.79 26.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.183 -0.462 . . . . 5.3099999999999996 111.295 -179.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 109' ' ' THR . . . . . 0.665 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 1.2 m -88.69 83.38 6.73 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.149 -0.686 . . . . 5.8700000000000001 109.149 178.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 110' ' ' ASN . . . . . 0.502 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 6.1 m-20 -67.24 103.08 1.16 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.707 -0.679 . . . . 6.9000000000000004 111.14 -178.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 1.1 m -110.85 114.39 27.7 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.415 -0.357 . . . . 8.9000000000000004 110.332 179.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 112' ' ' ASN . . . . . 0.495 HD21 HD11 ' B' ' 86' ' ' LEU . 4.6 t-20 -68.65 135.32 51.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.02 0.438 . . . . 11.84 110.772 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 9.4 t -104.29 -59.06 3.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.868 -0.606 . . . . 12.4 109.627 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 24.3 mtpt . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.207 -0.902 . . . . 12.68 109.945 -179.858 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.5 m . . . . . 0 N--CA 1.477 0.91 0 CA-C-O 120.75 0.309 . . . . 15.82 110.188 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.55 ' HA ' HG11 ' B' ' 71' ' ' VAL . 16.5 mt-30 -83.63 118.22 70.84 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.388 -0.369 . . . . 15.44 110.728 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -72.87 159.8 47.44 Favored 'Trans proline' 0 C--O 1.234 0.292 0 C-N-CA 122.859 2.373 . . . . 14.109999999999999 112.013 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.481 HG21 HG22 ' A' ' 32' ' ' THR . 0.1 OUTLIER -83.14 52.04 2.1 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.333 0.587 . . . . 11.369999999999999 111.106 179.92 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.66 ' HB2' HG22 ' A' ' 111' ' ' THR . 37.6 tt0 -147.09 136.93 23.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.446 -0.797 . . . . 10.59 108.964 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.828 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 42.5 p90 -151.75 154.16 35.72 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.071 0.463 . . . . 9.1999999999999993 111.489 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 21.1 mm -88.64 127.31 41.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.061 -0.518 . . . . 8.9399999999999995 110.842 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.891 ' HB3' ' HE2' ' A' ' 22' ' ' PHE . 1.4 m -110.23 97.39 6.88 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.831 -0.622 . . . . 6.1100000000000003 110.791 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 11.2 mtt180 -86.24 110.43 19.61 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.545 -0.539 . . . . 9.4600000000000009 109.545 179.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 33.3 p80 -147.03 156.2 42.83 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.629 -0.259 . . . . 10.369999999999999 110.558 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -76.62 -175.68 3.46 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.628 0.252 . . . . 13.279999999999999 110.926 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 26.9 pt -62.31 -25.44 37.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 N-CA-C 112.873 0.694 . . . . 13.970000000000001 112.873 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -76.5 -30.53 57.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.214 0.53 . . . . 13.85 110.669 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 118.02 -6.38 15.4 Favored Glycine 0 N--CA 1.444 -0.814 0 N-CA-C 111.225 -0.75 . . . . 9.6099999999999994 111.225 -179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.44 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 34.6 mm -68.69 117.84 11.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 O-C-N 123.973 0.455 . . . . 11.289999999999999 109.791 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.891 ' HE2' ' HB3' ' A' ' 14' ' ' SER . 87.7 m-85 -73.2 132.92 43.78 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.083 0.468 . . . . 10.449999999999999 112.081 -178.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.02 -27.37 12.17 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.3 -0.864 . . . . 8.1300000000000008 110.278 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.417 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 31.2 t80 -154.33 121.63 5.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.701 -0.681 . . . . 7.4900000000000002 109.516 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.61 ' HB ' ' HB3' ' A' ' 37' ' ' PRO . 4.8 t -110.39 146.36 15.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.033 0.444 . . . . 6.4500000000000002 111.236 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.828 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 6.0 t70 -68.5 170.89 8.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.546 -0.752 . . . . 7.3099999999999996 110.459 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -94.27 -21.43 19.02 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.11 0.481 . . . . 12.41 110.077 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 77.0 mtm180 -78.92 0.1 28.73 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.866 -0.606 . . . . 12.19 111.89 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 28.2 p -64.96 -33.51 76.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.972 0.415 . . . . 13.5 110.641 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.5 ' O ' ' HA2' ' A' ' 34' ' ' GLY . 2.9 t -69.59 -27.08 32.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.933 -0.576 . . . . 16.559999999999999 110.726 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.92 -24.38 26.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.105 0.479 . . . . 15.07 110.278 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.481 HG22 HG21 ' A' ' 10' ' ' THR . 25.2 m -85.01 -61.92 1.66 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.753 -0.658 . . . . 15.26 111.699 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.539 HG22 ' H ' ' A' ' 35' ' ' TYR . 15.6 m -111.35 -15.22 10.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 111.941 0.349 . . . . 14.18 111.941 -179.245 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.5 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 89.39 0.11 80.19 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.423 -0.894 . . . . 13.85 112.325 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.539 ' H ' HG22 ' A' ' 33' ' ' VAL . 0.7 OUTLIER -83.46 135.04 34.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.653 0.263 . . . . 18.59 110.458 179.882 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.656 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 79.0 mm-40 -75.41 146.71 81.49 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 116.054 -0.521 . . . . 15.890000000000001 110.059 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.61 ' HB3' ' HB ' ' A' ' 25' ' ' VAL . 41.6 Cg_exo -57.12 -35.35 98.89 Favored 'Trans proline' 0 CA--C 1.527 0.166 0 C-N-CA 122.588 2.192 . . . . 12.26 112.185 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.442 ' HA ' HD12 ' A' ' 41' ' ' LEU . 22.4 mp0 -69.25 -15.93 63.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.96 -0.564 . . . . 13.68 111.493 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.656 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 34.8 mt-10 -81.09 -32.48 33.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.786 0.327 . . . . 17.34 111.013 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.573 ' HB2' HG21 ' A' ' 25' ' ' VAL . 2.9 mm? -82.1 -24.66 35.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.121 -0.49 . . . . 13.56 110.915 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 89.7 mt -62.69 116.69 5.42 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.136 -0.484 . . . . 13.42 111.402 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.32 -4.26 85.34 Favored Glycine 0 N--CA 1.451 -0.339 0 CA-C-N 115.879 -0.601 . . . . 13.390000000000001 112.694 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.459 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 6.1 mmpt? -107.87 161.91 14.49 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.617 0.246 . . . . 17.239999999999998 110.457 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.747 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 15.1 m120 -95.66 139.02 32.51 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.544 -0.539 . . . . 12.77 109.544 179.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.569 HG13 ' HE1' ' A' ' 78' ' ' PHE . 9.1 tt -61.85 -30.37 48.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.016 0.436 . . . . 12.050000000000001 110.589 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.0 p -65.7 -22.03 30.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 116.183 -0.462 . . . . 13.390000000000001 111.254 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.747 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 41.1 mt-10 -73.83 -17.73 61.03 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.358 -0.383 . . . . 16.530000000000001 111.553 -179.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -117.97 24.53 10.96 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.17 0.51 . . . . 15.83 110.198 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 48.9 t -112.08 155.73 23.38 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.665 -0.698 . . . . 12.01 110.305 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.578 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 4.9 t-160 -56.92 122.33 51.93 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.842 -0.617 . . . . 15.130000000000001 109.408 178.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 99.2 Cg_exo -45.29 -49.06 10.7 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.456 2.77 . . . . 15.83 114.157 -178.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -75.77 0.93 16.22 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.291 0.478 . . . . 16.690000000000001 112.291 -179.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.578 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 26.4 m-20 -124.96 7.78 8.03 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.162 0.506 . . . . 13.16 110.159 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -66.35 -44.1 84.17 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.79 -0.641 . . . . 16.170000000000002 110.592 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.7 tp60 -62.58 -38.36 89.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.302 -0.408 . . . . 14.35 109.925 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.9 tp -57.48 -40.12 77.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.89 -0.595 . . . . 12.51 110.182 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.411 HD21 ' HA ' ' A' ' 57' ' ' LEU . 0.9 OUTLIER -69.59 -49.03 58.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.793 -0.639 . . . . 10.08 110.155 179.348 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.417 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 70.6 ttt180 -58.61 -48.61 80.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.986 -0.552 . . . . 11.710000000000001 111.392 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -56.56 -44.98 81.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.039 0.447 . . . . 9.7100000000000009 110.807 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.3 m -70.28 -31.36 68.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.017 -0.538 . . . . 9.5199999999999996 110.994 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.53 ' O ' HG23 ' A' ' 65' ' ' VAL . 1.4 m-30 -65.12 -49.99 67.79 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.048 -0.353 . . . . 12.109999999999999 110.048 178.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.417 ' HG2' ' O ' ' A' ' 58' ' ' ARG . 12.7 mm100 -64.8 -29.9 70.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.337 0.589 . . . . 10.289999999999999 109.572 179.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -66.27 -48.56 70.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.014 -0.993 . . . . 10.619999999999999 110.648 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.522 HG12 ' O ' ' A' ' 61' ' ' PHE . 4.3 p -64.74 -25.1 37.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-O 120.838 0.351 . . . . 10.93 110.87 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.59 ' HA ' HG21 ' A' ' 94' ' ' THR . 93.1 t -70.61 -40.39 77.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 108.954 -0.758 . . . . 12.890000000000001 108.954 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -72.97 -29.24 62.91 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.546 -0.752 . . . . 16.68 109.963 178.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.707 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 88.7 mt -70.13 -48.17 58.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.981 -0.554 . . . . 13.18 109.94 178.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 32.8 mttt 59.61 99.47 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.571 -0.741 . . . . 15.17 112.607 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.03 -26.27 13.75 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.674 -0.774 . . . . 10.01 112.886 178.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.707 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 7.9 tp-100 -79.11 113.12 16.98 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.744 0.307 . . . . 10.039999999999999 110.251 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 3.0 p -66.64 116.6 6.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.804 -0.634 . . . . 8.5399999999999991 110.805 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 64.8 tp -111.88 108.15 17.42 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.696 -0.684 . . . . 8.1300000000000008 110.381 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.566 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 1.2 m -87.45 109.33 19.51 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.961 -0.563 . . . . 7.8899999999999997 110.95 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.8 p -102.34 132.93 47.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.766 -0.457 . . . . 8.1799999999999997 109.766 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' MET . . . . . 0.471 ' HG2' ' HE3' ' A' ' 87' ' ' TRP . 23.1 ttt -102.41 122.0 43.44 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.904 0.383 . . . . 9.6999999999999993 111.07 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.518 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 47.8 p90 -148.89 -174.7 4.7 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.204 -0.453 . . . . 10.27 110.075 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.477 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 31.2 mtm180 -110.61 120.65 43.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.12 0.486 . . . . 13.859999999999999 110.297 178.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.569 ' HE1' HG13 ' A' ' 45' ' ' ILE . 15.9 t80 -101.0 153.51 19.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.311 -0.859 . . . . 9.7300000000000004 110.143 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.519 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 42.7 ttt180 -90.01 124.0 34.38 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.13 -0.486 . . . . 11.300000000000001 110.636 179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.424 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 59.5 p -85.84 -179.43 6.82 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.22 -0.446 . . . . 11.039999999999999 110.469 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -71.16 -14.45 62.28 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.516 0.674 . . . . 13.18 109.476 179.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.451 ' O ' ' HB2' ' A' ' 83' ' ' GLN . 87.9 m-20 -88.77 -1.79 58.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.435 -0.802 . . . . 14.890000000000001 109.74 179.031 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.451 ' HB2' ' O ' ' A' ' 82' ' ' ASN . 2.9 mp0 72.54 22.62 3.28 Favored 'General case' 0 N--CA 1.465 0.277 0 O-C-N 123.902 0.751 . . . . 12.92 110.748 -179.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.47 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.0 pt-20 -97.68 170.41 9.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.823 -0.626 . . . . 10.94 109.515 179.264 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.519 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 51.5 m95 -116.72 110.75 18.85 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.86 0.362 . . . . 11.77 110.529 -179.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 77' ' ' ARG . 0.5 OUTLIER -108.74 150.17 27.98 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.09 -0.504 . . . . 11.57 110.581 -179.821 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.889 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 72.0 m95 -82.35 117.12 22.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.972 0.415 . . . . 10.73 110.394 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.41 ' SD ' ' HB3' ' A' ' 110' ' ' ASN . 9.2 ttp -126.04 138.59 53.73 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.055 -0.52 . . . . 9.7400000000000002 110.602 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 89' ' ' ARG . 33.1 ttp-105 -103.81 107.38 18.23 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.896 -0.779 . . . . 11.16 108.896 178.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.611 HG22 ' HB3' ' A' ' 108' ' ' CYS . 24.7 m -92.61 105.37 17.54 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.742 -0.663 . . . . 9.5899999999999999 112.426 -178.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.767 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 64.0 m -82.28 87.21 6.57 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.525 -0.917 . . . . 8.8800000000000008 108.525 177.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.485 ' HA ' ' HA ' ' A' ' 108' ' ' CYS . 32.8 m -74.98 125.23 28.46 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.059 -0.519 . . . . 8.9399999999999995 111.739 -178.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -123.41 109.52 13.97 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.593 -0.73 . . . . 12.1 109.58 179.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.59 HG21 ' HA ' ' A' ' 65' ' ' VAL . 0.2 OUTLIER -72.11 123.41 22.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.424 -0.353 . . . . 10.16 110.483 179.922 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . 0.441 ' O ' ' HA ' ' A' ' 103' ' ' ILE . 23.0 t80 -92.48 113.21 25.43 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.929 0.395 . . . . 12.6 111.09 -179.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -92.62 132.21 37.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.855 -0.611 . . . . 14.6 110.487 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -85.29 138.62 36.4 Favored Pre-proline 0 C--N 1.319 -0.751 0 N-CA-C 109.752 -0.462 . . . . 13.83 109.752 178.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -64.2 -11.45 27.84 Favored 'Trans proline' 0 CA--C 1.531 0.362 0 C-N-CA 122.753 2.302 . . . . 15.34 114.053 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -62.98 -74.7 0.09 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.741 0.305 . . . . 16.890000000000001 110.998 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.3 m -127.08 24.52 6.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.579 -0.282 . . . . 15.140000000000001 110.966 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 28.7 t70 62.64 35.52 14.19 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.445 0.641 . . . . 14.94 110.615 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.1 139.47 30.94 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.406 -0.361 . . . . 12.949999999999999 110.382 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.441 ' HA ' ' O ' ' A' ' 95' ' ' PHE . 50.5 mt -83.32 106.97 14.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.209 -0.45 . . . . 11.44 109.967 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -73.2 -38.96 65.93 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.882 -0.327 . . . . 11.65 110.661 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.457 ' HE1' HG12 ' A' ' 107' ' ' ILE . 16.3 p90 -159.8 167.98 26.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.378 -0.374 . . . . 10.35 110.291 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 21.4 mt -110.18 120.63 61.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.969 -0.56 . . . . 10.470000000000001 110.138 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.614 HG23 HH22 ' B' ' 15' ' ' ARG . 15.7 mt -88.54 95.92 5.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.098 -0.501 . . . . 9.3200000000000003 109.657 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.611 ' HB3' HG22 ' A' ' 90' ' ' THR . 96.3 m -91.07 116.32 28.7 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.086 -0.507 . . . . 10.15 111.936 -178.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.767 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 2.8 m -86.97 97.55 10.76 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.798 -0.815 . . . . 11.4 108.798 178.286 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.435 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 8.5 m-20 -86.14 104.82 16.07 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.143 -0.481 . . . . 11.640000000000001 111.908 -177.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.66 HG22 ' HB2' ' A' ' 11' ' ' GLU . 1.9 m -112.15 120.05 40.48 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.751 -0.462 . . . . 11.220000000000001 109.751 178.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . 0.47 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 2.6 t-20 -72.13 129.57 38.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.182 0.515 . . . . 12.98 111.072 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 3.5 t -103.45 -46.36 10.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.543 -0.753 . . . . 15.109999999999999 110.058 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.889 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 51.8 mtpt . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.44 -0.79 . . . . 16.32 109.74 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 56.1 m . . . . . 0 N--CA 1.479 1.02 0 CA-C-O 120.989 0.423 . . . . 7.8399999999999999 110.373 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' GLN . . . . . 0.812 ' HG3' ' HA ' ' B' ' 28' ' ' ARG . 1.7 pm0 -108.15 150.6 40.67 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.234 -0.439 . . . . 7.4900000000000002 109.887 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' B' ' 8' ' ' GLN . 11.3 Cg_exo -72.32 176.23 8.9 Favored 'Trans proline' 0 C--O 1.234 0.287 0 C-N-CA 122.842 2.361 . . . . 6.4400000000000004 112.23 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' THR . . . . . 0.785 HG21 ' HA ' ' B' ' 32' ' ' THR . 0.1 OUTLIER -82.59 50.5 1.67 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.272 -0.422 . . . . 5.9800000000000004 111.684 -179.718 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.584 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -148.28 139.71 23.53 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.608 -0.515 . . . . 5.8499999999999996 109.608 179.709 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' PHE . . . . . 0.692 ' HB3' ' HB2' ' B' ' 28' ' ' ARG . 33.8 p90 -155.28 153.37 30.49 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.018 0.437 . . . . 6.4900000000000002 111.245 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . 0.568 HG13 HG21 ' B' ' 107' ' ' ILE . 9.1 tt -88.03 113.26 24.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.651 -0.704 . . . . 6.0199999999999996 110.47 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.422 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.7 OUTLIER -98.1 91.66 5.39 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.963 -0.562 . . . . 5.3700000000000001 110.633 179.641 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . 0.614 HH22 HG23 ' A' ' 107' ' ' ILE . 8.7 mtp180 -82.56 111.22 18.35 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.884 -0.784 . . . . 9.4600000000000009 108.884 179.281 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . 0.765 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 0.6 OUTLIER -146.51 172.5 13.46 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.367 -0.379 . . . . 8.3100000000000005 111.425 -178.55 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -82.01 175.53 10.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.204 -0.453 . . . . 11.19 110.98 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 18.2 pt -58.82 -28.49 37.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 N-CA-C 113.039 0.755 . . . . 9.3699999999999992 113.039 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -79.22 -10.37 59.8 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.882 0.372 . . . . 11.92 111.51 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 101.86 -8.35 55.99 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.452 -0.88 . . . . 8.6799999999999997 112.987 179.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . 0.489 ' O ' ' HB2' ' B' ' 16' ' ' HIS . 24.8 mm -63.86 111.97 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 110.235 -0.283 . . . . 11.16 110.235 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . 0.765 ' HA ' ' HB3' ' B' ' 16' ' ' HIS . 97.4 m-85 -63.75 125.13 23.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.125 -0.489 . . . . 8.5999999999999996 111.705 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 3.1 m -98.87 -44.47 6.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.537 -0.756 . . . . 7.9100000000000001 110.605 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . 0.604 ' HD2' ' HD3' ' B' ' 15' ' ' ARG . 78.5 t80 -147.35 123.0 10.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.878 -0.601 . . . . 8.5 109.983 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 25.7 t -120.72 131.58 72.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.177 -0.465 . . . . 6.5 110.361 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -69.77 158.94 34.49 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.748 -0.464 . . . . 7.1500000000000004 109.748 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -78.2 51.03 0.96 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.29 -0.414 . . . . 9.4100000000000001 111.717 -178.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . 0.812 ' HA ' ' HG3' ' B' ' 8' ' ' GLN . 23.5 mtm180 -125.37 -16.98 5.74 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.816 0.341 . . . . 9.7599999999999998 110.583 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 22.7 p -61.71 -27.01 68.41 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.167 -0.469 . . . . 11.56 111.656 -179.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . 0.426 HG12 HE22 ' B' ' 36' ' ' GLN . 34.0 t -59.75 -39.52 79.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.052 -0.522 . . . . 14.01 111.19 -179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.9 -15.4 39.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.332 -0.395 . . . . 12.9 111.285 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' THR . . . . . 0.785 ' HA ' HG21 ' B' ' 10' ' ' THR . 4.1 m -88.59 -53.27 4.73 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.254 0.464 . . . . 12.34 112.254 -178.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' VAL . . . . . 0.628 HG13 ' HD2' ' B' ' 78' ' ' PHE . 3.5 m -124.93 -13.07 5.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 112.455 0.539 . . . . 13.869999999999999 112.455 -178.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.1 -21.0 36.56 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.4 -0.905 . . . . 14.369999999999999 112.06 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -67.08 128.88 38.02 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.92 -0.4 . . . . 15.56 109.92 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . 0.557 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 27.5 mm-40 -74.99 149.79 85.46 Favored Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 109.62 -0.511 . . . . 13.859999999999999 109.62 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.587 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 61.9 Cg_exo -51.4 -42.27 55.72 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.748 2.298 . . . . 15.210000000000001 112.503 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 -62.17 -27.92 69.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.907 -0.588 . . . . 17.82 111.577 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.557 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 30.6 mt-10 -72.84 -33.22 66.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.385 -0.371 . . . . 14.42 110.449 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.404 ' HB3' ' CG ' ' B' ' 22' ' ' PHE . 1.1 mm? -80.83 -30.89 35.69 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.104 -0.498 . . . . 14.550000000000001 111.106 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 79.6 mt -60.03 119.19 7.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 14.050000000000001 110.937 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.05 5.61 73.03 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.976 -0.63 . . . . 11.68 112.448 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.483 ' O ' ' HA ' ' B' ' 21' ' ' ILE . 1.7 mmpt? -116.64 154.29 30.79 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.63 0.252 . . . . 14.17 110.747 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' ASN . . . . . 0.92 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 15.3 m120 -89.47 135.4 33.62 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.542 -0.54 . . . . 10.74 109.542 179.331 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . 0.417 HG21 ' HZ ' ' B' ' 61' ' ' PHE . 19.0 tt -61.96 -26.39 39.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.156 0.503 . . . . 9.8800000000000008 110.634 179.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' VAL . . . . . 0.523 HG12 ' HB3' ' B' ' 44' ' ' ASN . 14.4 p -71.24 -22.1 22.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 CA-C-N 115.815 -0.629 . . . . 11.779999999999999 111.353 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . 0.92 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 35.9 mt-10 -69.69 -35.86 75.47 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.087 0.47 . . . . 11.890000000000001 110.652 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 16.8 m-85 -97.11 8.78 43.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.883 -0.599 . . . . 14.279999999999999 109.915 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 44.4 t -93.27 147.79 22.6 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.861 -0.609 . . . . 10.81 110.858 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 5.4 t-160 -58.7 128.75 84.26 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.47 -0.787 . . . . 12.029999999999999 109.595 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -46.91 -51.09 9.77 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.186 2.591 . . . . 11.869999999999999 113.412 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -68.35 -5.26 17.84 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.311 0.486 . . . . 9.2799999999999994 112.311 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -120.8 5.5 10.48 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.692 0.282 . . . . 7.5199999999999996 111.185 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -64.07 -52.43 59.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.443 -0.344 . . . . 6.5700000000000003 111.312 -179.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . 0.528 ' OE1' ' HD3' ' B' ' 58' ' ' ARG . 51.9 tp60 -63.95 -30.8 71.85 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.849 -0.426 . . . . 6.9900000000000002 109.849 179.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.7 tp -59.17 -50.55 73.59 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.213 -0.662 . . . . 5.1399999999999997 109.213 178.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . 0.429 ' HA ' HD22 ' B' ' 57' ' ' LEU . 0.3 OUTLIER -67.56 -41.42 84.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.765 -0.652 . . . . 6.8200000000000003 109.88 178.837 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . 0.528 ' HD3' ' OE1' ' B' ' 55' ' ' GLN . 38.5 ttt180 -55.21 -53.46 55.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.484 -0.78 . . . . 8.6899999999999995 111.358 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . 0.45 ' O ' ' HG3' ' B' ' 63' ' ' GLN . 22.3 t70 -62.71 -37.81 87.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.468 -0.333 . . . . 6.46 110.453 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 50.9 m -61.67 -35.56 78.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 5.5899999999999999 110.58 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' PHE . . . . . 0.534 ' O ' HG12 ' B' ' 64' ' ' VAL . 8.1 m-85 -63.59 -43.31 97.34 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 121.042 0.449 . . . . 8.3300000000000001 109.901 178.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -68.47 -34.95 76.83 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.475 -0.565 . . . . 7.1500000000000004 109.475 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.45 ' HG3' ' O ' ' B' ' 59' ' ' ASP . 52.9 mt-30 -61.67 -47.53 84.94 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.702 -0.681 . . . . 9.5299999999999994 110.968 179.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.534 HG12 ' O ' ' B' ' 61' ' ' PHE . 4.0 p -65.45 -29.82 48.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.402 -0.363 . . . . 8.2200000000000006 111.216 -179.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . 0.514 HG23 ' O ' ' B' ' 61' ' ' PHE . 72.7 t -69.54 -37.51 74.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 109.455 -0.572 . . . . 7.4299999999999997 109.455 178.649 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -72.0 -27.28 62.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.663 -0.699 . . . . 10.52 110.081 178.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.454 ' HB3' ' HB2' ' B' ' 70' ' ' GLN . 52.2 mt -73.08 -61.69 1.73 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.646 -0.706 . . . . 7.5300000000000002 110.531 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 37.0 mttt 65.52 108.99 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.298 0 O-C-N 123.876 0.735 . . . . 8.0099999999999998 111.471 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 79.4 14.16 81.8 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.811 -0.709 . . . . 5.8700000000000001 112.297 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . 0.454 ' HB2' ' HB3' ' B' ' 67' ' ' LEU . 1.3 mp0 -125.19 157.37 36.65 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.237 -0.653 . . . . 5.6299999999999999 109.237 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' VAL . . . . . 0.55 HG11 ' HA ' ' A' ' 8' ' ' GLN . 13.4 p -107.75 136.51 42.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.377 0.608 . . . . 6.0599999999999996 111.121 -179.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 11.5 tp -123.25 111.44 16.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.696 -0.684 . . . . 4.9299999999999997 109.938 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 0.3 OUTLIER -89.13 117.02 27.82 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.125 -0.489 . . . . 6.79 111.038 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 7.6 p -116.18 135.87 54.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.753 -0.462 . . . . 4.4199999999999999 109.753 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 22.8 ttt -106.91 110.57 22.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.21 0.528 . . . . 5.6699999999999999 111.142 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.412 ' HE2' ' HD1' ' B' ' 78' ' ' PHE . 45.1 p90 -137.07 -178.98 5.44 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.661 -0.7 . . . . 3.75 109.245 179.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' ARG . . . . . 0.555 ' HD2' ' HB3' ' B' ' 85' ' ' TRP . 37.9 mtm180 -106.5 122.2 45.81 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.08 0.467 . . . . 7.3499999999999996 110.626 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . 0.628 ' HD2' HG13 ' B' ' 33' ' ' VAL . 15.6 t80 -103.81 150.58 23.98 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.64 -0.709 . . . . 5.79 109.889 -179.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' B' ' 79' ' ' ARG . 30.1 ttp180 -89.62 134.22 34.24 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.383 -0.371 . . . . 11.529999999999999 110.468 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 82.0 p -93.29 -176.38 4.12 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.217 -0.447 . . . . 7.4699999999999998 110.087 179.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -70.73 -14.93 62.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.428 0.632 . . . . 12.67 109.391 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 68.5 m-20 -92.11 1.08 57.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.373 -0.83 . . . . 9.25 109.489 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' GLN . . . . . 0.404 ' HA ' ' HG2' ' B' ' 79' ' ' ARG . 2.3 mp0 67.03 22.79 9.9 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.167 -0.924 . . . . 8.75 111.241 -179.463 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -94.31 157.2 16.15 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.465 -0.569 . . . . 6.8700000000000001 109.465 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . 0.555 ' HB3' ' HD2' ' B' ' 77' ' ' ARG . 81.6 m95 -99.38 116.45 31.57 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.832 0.348 . . . . 8.3800000000000008 110.835 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 pp -119.32 145.83 45.81 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.174 -0.467 . . . . 7.25 110.027 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' TRP . . . . . 0.439 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 94.7 m95 -76.39 120.62 21.89 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.098 0.475 . . . . 9.3000000000000007 110.777 -179.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 30.7 tpp -119.62 128.99 54.37 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.49 -0.777 . . . . 4.46 111.166 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 20.4 ttp180 -99.2 82.54 2.72 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.714 -0.847 . . . . 7.3099999999999996 108.714 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' THR . . . . . 0.492 HG22 ' HB3' ' B' ' 108' ' ' CYS . 47.8 m -75.66 114.87 14.74 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.534 -0.757 . . . . 6.1799999999999997 111.712 -178.711 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' B' ' 73' ' ' SER . 1.4 m -96.73 95.93 8.25 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.565 -0.743 . . . . 6.4500000000000002 109.119 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 10.3 m -84.07 123.4 30.0 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.185 -0.461 . . . . 6.75 112.028 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . 0.45 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 65.0 t80 -120.48 122.58 40.97 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.92 -0.582 . . . . 6.4500000000000002 109.555 179.123 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.79 113.89 21.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.708 0.29 . . . . 9.8800000000000008 111.368 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . 0.477 ' HD1' ' HA ' ' B' ' 95' ' ' PHE . 0.0 OUTLIER -82.68 122.6 28.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 8.9100000000000001 110.188 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -98.45 119.35 36.99 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.705 -0.679 . . . . 10.99 111.041 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 97' ' ' ASN . . . . . 0.419 ' C ' ' H ' ' B' ' 99' ' ' TYR . 67.0 t30 -71.27 123.76 89.89 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 108.78 -0.822 . . . . 8.5099999999999998 108.78 178.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.68 21.67 0.17 Allowed 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.023 2.482 . . . . 9.1600000000000001 114.151 -178.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . 0.419 ' H ' ' C ' ' B' ' 97' ' ' ASN . 5.3 t80 -94.69 -68.72 0.79 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.564 -0.532 . . . . 11.390000000000001 109.564 179.408 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 6.1 m -129.66 20.1 5.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.088 -0.505 . . . . 7.9000000000000004 110.252 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 33.7 t70 66.72 41.54 2.93 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.349 -0.842 . . . . 9.0800000000000001 111.19 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -96.2 140.06 31.45 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.403 -0.362 . . . . 7.71 110.258 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 63.5 mt -79.63 108.83 13.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.561 -0.533 . . . . 8.3800000000000008 109.561 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.401 ' H ' ' HG2' ' B' ' 104' ' ' GLU . 6.4 pt-20 -72.94 -45.18 59.52 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.519 -0.309 . . . . 8.8100000000000005 111.025 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -165.55 167.6 17.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.455 -0.339 . . . . 7.8200000000000003 110.382 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 67.5 mt -106.0 121.85 58.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.959 -0.564 . . . . 7.2199999999999998 110.155 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . 0.568 HG21 HG13 ' B' ' 13' ' ' ILE . 83.4 mt -87.75 100.03 9.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.893 -0.594 . . . . 6.7199999999999998 109.734 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' CYS . . . . . 0.492 ' HB3' HG22 ' B' ' 90' ' ' THR . 68.1 m -100.6 97.91 8.54 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 120.823 -0.351 . . . . 5.3099999999999996 111.522 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 46.3 m -75.36 99.29 4.08 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.121 -0.696 . . . . 5.8700000000000001 109.121 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' ASN . . . . . 0.529 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.3 m-20 -80.46 109.27 14.81 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.654 -0.703 . . . . 6.9000000000000004 110.899 -178.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' THR . . . . . 0.456 HG22 ' HB2' ' B' ' 11' ' ' GLU . 0.3 OUTLIER -113.09 110.88 21.19 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.114 -0.494 . . . . 8.9000000000000004 110.127 179.245 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' ASN . . . . . 0.707 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 10.8 t-20 -70.59 129.77 40.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.992 0.425 . . . . 11.84 110.754 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 38.8 t -106.36 -51.16 7.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.838 -0.619 . . . . 12.4 110.057 179.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . 0.439 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 34.4 mtpt . . . . . 0 C--O 1.246 0.889 0 CA-C-O 118.567 -0.73 . . . . 12.68 110.217 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 75.5 m . . . . . 0 N--CA 1.474 0.76 0 CA-C-O 120.79 0.329 . . . . 15.82 110.407 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.2 mm-40 -101.29 104.25 31.95 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.839 -0.619 . . . . 15.44 109.831 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.89 153.85 67.86 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.742 2.295 . . . . 14.109999999999999 112.751 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.788 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.2 OUTLIER -79.53 52.49 1.4 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.347 0.594 . . . . 11.369999999999999 111.079 179.609 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.482 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 40.8 tt0 -152.37 123.75 7.72 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.417 -0.81 . . . . 10.59 108.825 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.76 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 44.7 p90 -139.79 151.11 45.5 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.066 0.46 . . . . 9.1999999999999993 111.732 -178.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.64 HG13 HD13 ' B' ' 107' ' ' ILE . 0.0 OUTLIER -111.32 129.31 66.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.784 -0.644 . . . . 8.9399999999999995 109.866 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.5 m -134.32 139.29 45.57 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.316 0.579 . . . . 6.1100000000000003 112.35 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.59 ' HD2' ' HD2' ' A' ' 24' ' ' PHE . 6.5 mtt85 -89.54 133.37 34.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.161 -0.927 . . . . 9.4600000000000009 108.978 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.507 ' CB ' ' HA ' ' A' ' 22' ' ' PHE . 33.5 p80 -154.89 158.69 39.71 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.183 0.516 . . . . 10.369999999999999 111.751 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -65.85 155.7 35.53 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.992 -1.004 . . . . 13.279999999999999 109.278 178.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 18.4 pt -53.87 -31.02 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 N-CA-C 112.406 0.521 . . . . 13.970000000000001 112.406 -179.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -75.12 -16.59 60.53 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.821 0.343 . . . . 13.85 111.83 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 120.58 -19.48 9.08 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.308 -0.949 . . . . 9.6099999999999994 113.553 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.475 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 30.6 mm -57.5 110.36 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 116.829 0.314 . . . . 11.289999999999999 110.978 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.507 ' HA ' ' CB ' ' A' ' 16' ' ' HIS . 82.3 m-85 -71.95 138.78 48.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.973 0.416 . . . . 10.449999999999999 111.457 -179.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.6 m -115.4 -36.9 4.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.756 -0.656 . . . . 8.1300000000000008 110.891 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.59 ' HD2' ' HD2' ' A' ' 15' ' ' ARG . 18.6 t80 -139.48 110.7 6.95 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.409 -0.589 . . . . 7.4900000000000002 109.409 179.318 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.548 HG22 ' HB2' ' A' ' 40' ' ' LEU . 7.3 t -97.61 150.24 4.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 116.447 -0.342 . . . . 6.4500000000000002 110.776 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.76 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 7.8 t70 -69.35 172.58 6.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.704 -0.68 . . . . 7.3099999999999996 110.087 179.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -91.02 -21.38 21.3 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.124 0.488 . . . . 12.41 109.828 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 76.5 mtm180 -84.41 5.69 26.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.633 -0.712 . . . . 12.19 111.943 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 4.5 p -59.94 -42.92 95.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.323 0.582 . . . . 13.5 110.441 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.575 HG12 HE22 ' A' ' 36' ' ' GLN . 4.1 t -66.45 -28.88 44.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.522 -0.763 . . . . 16.559999999999999 111.04 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.24 -6.12 59.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.16 -0.473 . . . . 15.07 111.684 -179.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.452 ' HA ' HG21 ' A' ' 10' ' ' THR . 18.4 m -109.71 -56.99 2.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.724 0.297 . . . . 15.26 111.334 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.612 HG21 ' HB2' ' A' ' 35' ' ' TYR . 11.1 m -113.17 -19.61 6.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.704 0.288 . . . . 14.18 111.702 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 94.51 -8.84 71.73 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.462 -0.875 . . . . 13.85 112.359 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.612 ' HB2' HG21 ' A' ' 33' ' ' VAL . 4.6 m-85 -74.01 136.76 43.17 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.377 -0.231 . . . . 18.59 110.377 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.575 HE22 HG12 ' A' ' 30' ' ' VAL . 33.3 mm-40 -80.7 153.54 73.16 Favored Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 109.139 -0.689 . . . . 15.890000000000001 109.139 178.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.564 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 52.6 Cg_exo -53.56 -38.97 84.18 Favored 'Trans proline' 0 CA--C 1.529 0.237 0 C-N-CA 122.568 2.179 . . . . 12.26 112.712 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -71.11 -14.63 62.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.219 -0.446 . . . . 13.68 111.665 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.522 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 34.2 mt-10 -82.31 -20.65 36.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.911 0.386 . . . . 17.34 110.366 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.548 ' HB2' HG22 ' A' ' 25' ' ' VAL . 3.3 mm? -95.51 -24.11 16.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.771 -0.649 . . . . 13.56 110.495 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 82.5 mt -61.0 122.79 15.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.849 -0.614 . . . . 13.42 111.028 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . 0.411 ' HA2' HG23 ' A' ' 21' ' ' ILE . . . 76.31 9.18 85.82 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.879 -0.677 . . . . 13.390000000000001 112.586 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.726 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 9.0 mmpt? -114.1 153.39 29.57 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.908 0.385 . . . . 17.239999999999998 110.667 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.481 ' HB3' HG12 ' A' ' 46' ' ' VAL . 16.2 m120 -94.84 138.22 32.9 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.85 -0.613 . . . . 12.77 109.48 179.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.7 tt -61.14 -23.23 29.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.146 0.498 . . . . 12.050000000000001 110.856 179.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.481 HG12 ' HB3' ' A' ' 44' ' ' ASN . 11.5 p -70.8 -20.71 22.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 116.075 -0.511 . . . . 13.390000000000001 111.432 -179.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -72.75 -39.24 66.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.194 0.521 . . . . 16.530000000000001 110.461 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -97.36 19.44 13.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.679 -0.691 . . . . 15.83 110.396 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.638 ' HG ' HD12 ' A' ' 57' ' ' LEU . 49.8 t -104.56 149.5 25.45 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.837 -0.619 . . . . 12.01 110.513 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.4 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 4.9 t-160 -58.16 125.31 74.26 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.507 -0.77 . . . . 15.130000000000001 109.335 178.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.434 ' HA ' ' CD ' ' A' ' 54' ' ' GLN . 88.5 Cg_exo -48.89 -38.99 39.52 Favored 'Trans proline' 0 CA--C 1.533 0.452 0 C-N-CA 123.089 2.526 . . . . 15.83 113.823 -178.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -81.46 0.67 36.69 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.939 0.348 . . . . 16.690000000000001 111.939 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.4 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 36.7 m-20 -125.76 2.31 7.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.831 0.348 . . . . 13.16 110.978 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.434 ' CD ' ' HA ' ' A' ' 51' ' ' PRO . 85.5 mt-30 -61.99 -39.76 93.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.134 -0.484 . . . . 16.170000000000002 111.059 -179.395 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 -66.74 -44.38 81.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.262 -0.426 . . . . 14.35 110.211 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.2 tp -59.96 -41.97 93.08 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.218 -0.446 . . . . 12.51 110.37 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.638 HD12 ' HG ' ' A' ' 49' ' ' CYS . 0.2 OUTLIER -62.56 -53.09 59.91 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.003 -0.544 . . . . 10.08 110.114 179.307 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.414 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 52.7 ttt180 -59.77 -45.52 92.01 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.581 -0.736 . . . . 11.710000000000001 111.412 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -58.58 -46.72 86.32 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.335 -0.393 . . . . 9.7100000000000009 111.025 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.3 m -66.46 -33.65 76.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.201 -0.454 . . . . 9.5199999999999996 110.812 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.476 ' O ' HG12 ' A' ' 64' ' ' VAL . 1.8 m-30 -64.44 -30.08 71.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.065 0.459 . . . . 12.109999999999999 109.924 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.414 ' HG2' ' O ' ' A' ' 58' ' ' ARG . 18.7 mm100 -79.13 -31.72 44.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.855 -0.611 . . . . 10.289999999999999 110.236 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -66.49 -42.49 87.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.876 -0.602 . . . . 10.619999999999999 110.972 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.476 HG12 ' O ' ' A' ' 61' ' ' PHE . 9.5 p -64.01 -25.98 39.43 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-O 121.011 0.434 . . . . 10.93 110.399 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.475 ' HA ' HG21 ' A' ' 94' ' ' THR . 82.7 t -72.58 -38.31 58.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 109.382 -0.599 . . . . 12.890000000000001 109.382 178.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 41.5 mtpt -68.98 -40.81 78.57 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.717 -0.674 . . . . 16.68 110.022 179.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.673 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 86.9 mt -62.57 -49.63 74.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.669 -0.696 . . . . 13.18 110.75 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 62.5 mttt 66.01 99.37 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.815 -0.63 . . . . 15.17 112.394 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 82.16 14.37 77.04 Favored Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 121.029 -0.605 . . . . 10.01 113.356 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.673 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 7.3 tp-100 -119.74 123.62 44.19 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.551 -0.537 . . . . 10.039999999999999 109.551 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 6.8 p -71.35 126.32 31.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.297 0.57 . . . . 8.5399999999999991 111.128 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 22.4 tp -115.73 123.97 49.64 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.811 -0.631 . . . . 8.1300000000000008 109.706 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -92.54 116.7 29.23 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.085 -0.507 . . . . 7.8899999999999997 111.262 -179.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.1 p -119.56 122.8 69.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.106 0.479 . . . . 8.1799999999999997 110.253 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 11.7 ttt -100.36 127.31 46.71 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.259 -0.428 . . . . 9.6999999999999993 111.172 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.502 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 45.3 p90 -154.18 -179.57 8.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.915 -0.584 . . . . 10.27 109.755 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.445 ' HD2' ' HB3' ' A' ' 85' ' ' TRP . 11.4 mtm180 -100.86 119.83 39.25 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.907 0.384 . . . . 13.859999999999999 109.987 179.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.502 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 21.5 t80 -104.9 150.59 24.74 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.883 -0.598 . . . . 9.7300000000000004 110.475 -179.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.538 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 28.3 ttp180 -86.5 133.08 33.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.323 -0.399 . . . . 11.300000000000001 110.573 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 59.8 p -93.11 -175.36 3.83 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.675 -0.491 . . . . 11.039999999999999 109.675 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.436 ' HD2' ' HA ' ' A' ' 81' ' ' LYS . 37.6 tptt -72.24 -14.65 61.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.25 0.548 . . . . 13.18 109.704 178.514 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -95.48 5.23 52.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.729 -0.668 . . . . 14.890000000000001 109.768 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 68.08 23.58 8.02 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.162 -0.926 . . . . 12.92 112.018 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.467 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.5 pt-20 -94.01 161.88 14.11 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.789 -0.449 . . . . 10.94 109.789 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.538 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 81.7 m95 -107.16 106.16 16.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.816 0.341 . . . . 11.77 110.288 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.464 HD21 HG12 ' A' ' 33' ' ' VAL . 1.6 pp -105.78 148.67 27.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.198 -0.455 . . . . 11.57 110.866 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.671 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 96.3 m95 -81.29 117.18 21.57 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.294 -0.412 . . . . 10.73 110.068 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.481 ' SD ' ' HB3' ' A' ' 110' ' ' ASN . 3.7 ttp -130.61 141.52 50.44 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.255 -0.43 . . . . 9.7400000000000002 111.193 -179.015 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -103.25 100.49 10.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.717 -0.674 . . . . 11.16 109.323 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.516 HG22 ' HB3' ' A' ' 108' ' ' CYS . 37.7 m -82.91 113.93 20.85 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.247 0.546 . . . . 9.5899999999999999 111.511 -179.289 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.684 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 0.7 OUTLIER -91.78 91.15 7.81 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.688 -0.856 . . . . 8.8800000000000008 108.688 178.382 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.1 m -82.0 131.07 35.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.075 -0.511 . . . . 8.9399999999999995 111.896 -178.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -127.12 121.6 31.88 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.771 -0.65 . . . . 12.1 109.812 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.475 HG21 ' HA ' ' A' ' 65' ' ' VAL . 0.0 OUTLIER -76.31 111.28 11.58 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.911 0.386 . . . . 10.16 110.695 179.717 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -81.44 100.73 9.44 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.136 0.493 . . . . 12.6 110.049 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.477 ' HG2' HG12 ' A' ' 103' ' ' ILE . 37.4 mt-30 -90.2 152.99 20.84 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.732 -0.667 . . . . 14.6 111.31 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.425 ' OD1' ' HB2' ' A' ' 99' ' ' TYR . 15.6 t-20 -102.82 130.35 23.99 Favored Pre-proline 0 C--N 1.32 -0.684 0 CA-C-N 115.427 -0.806 . . . . 13.83 109.046 179.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -76.22 54.62 4.29 Favored 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.576 2.184 . . . . 15.34 112.876 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.425 ' HB2' ' OD1' ' A' ' 97' ' ' ASN . 4.3 t80 -125.95 -55.25 1.49 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 16.890000000000001 110.348 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -138.41 22.2 2.75 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.983 -0.553 . . . . 15.140000000000001 109.746 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 10.0 t70 63.29 33.23 14.24 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.59 -0.732 . . . . 14.94 110.021 -179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -90.45 162.58 15.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.92 -0.582 . . . . 12.949999999999999 110.289 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.477 HG12 ' HG2' ' A' ' 96' ' ' GLN . 43.8 mt -110.58 119.85 60.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.78 -0.452 . . . . 11.44 109.78 179.406 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.81 -40.76 27.85 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.856 -0.338 . . . . 11.65 110.737 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 14.4 p90 -169.16 -178.18 3.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.258 -0.428 . . . . 10.35 110.209 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 73.0 mt -121.59 127.16 75.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.876 0.37 . . . . 10.470000000000001 110.88 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.535 HG22 HG22 ' A' ' 13' ' ' ILE . 19.3 mt -99.62 122.3 51.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 108.623 -0.88 . . . . 9.3200000000000003 108.623 178.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.516 ' HB3' HG22 ' A' ' 90' ' ' THR . 81.5 m -110.26 132.21 54.37 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.255 0.55 . . . . 10.15 112.452 -178.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.684 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 12.8 m -100.27 95.8 7.03 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.776 -1.102 . . . . 11.4 108.447 178.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.482 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 6.7 m-20 -81.93 105.85 13.38 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.093 -0.503 . . . . 11.640000000000001 111.839 -178.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 1.7 m -102.3 112.56 25.31 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.802 -0.635 . . . . 11.220000000000001 110.085 178.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . 0.788 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 10.0 t-20 -72.47 125.28 27.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.905 0.383 . . . . 12.98 110.55 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 46.4 t -102.98 -50.21 9.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.158 -0.474 . . . . 15.109999999999999 109.897 179.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.671 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 89.8 mttt . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.283 -0.865 . . . . 16.32 110.09 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 80.3 m . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 109.939 -0.393 . . . . 7.8399999999999999 109.939 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -133.74 146.32 59.76 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 116.646 -0.252 . . . . 7.4900000000000002 110.537 -179.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . 0.692 ' HD2' ' HG2' ' B' ' 28' ' ' ARG . 18.1 Cg_exo -67.54 167.57 20.46 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 123.025 2.483 . . . . 6.4400000000000004 112.104 179.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.97 57.89 3.62 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.479 0.656 . . . . 5.9800000000000004 111.136 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.496 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -166.62 148.62 6.46 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.315 -0.995 . . . . 5.8499999999999996 108.315 179.043 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 47.7 p90 -156.21 162.74 40.14 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.422 0.629 . . . . 6.4900000000000002 112.06 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . 0.677 HG21 HG21 ' B' ' 107' ' ' ILE . 27.0 mm -96.33 117.35 40.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 114.912 -1.04 . . . . 6.0199999999999996 110.409 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.447 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.9 OUTLIER -106.86 101.86 11.26 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.005 -0.543 . . . . 5.3700000000000001 110.831 -179.769 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . 0.545 ' HD3' ' HB3' ' B' ' 24' ' ' PHE . 26.8 mtp85 -91.94 108.01 19.62 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.175 -0.676 . . . . 9.4600000000000009 109.175 179.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . 0.528 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 31.9 p80 -139.55 164.46 29.84 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.345 -0.389 . . . . 8.3100000000000005 110.897 -178.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 10.8 p-10 -75.71 -177.83 3.92 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.408 -0.36 . . . . 11.19 110.48 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 33.9 pt -65.64 -28.17 43.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 112.455 0.539 . . . . 9.3699999999999992 112.455 -178.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -72.69 -32.75 66.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.724 0.297 . . . . 11.92 110.934 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 125.58 -11.4 7.52 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.578 -0.82 . . . . 8.6799999999999997 112.267 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 39.3 mm -62.12 112.64 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.775 0.321 . . . . 11.16 110.388 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . 0.528 ' HA ' ' HB3' ' B' ' 16' ' ' HIS . 97.2 m-85 -69.81 129.68 40.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.97 -0.559 . . . . 8.5999999999999996 111.279 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.85 -33.91 7.82 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.82 -0.627 . . . . 7.9100000000000001 110.607 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . 0.545 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 37.8 t80 -152.05 124.69 8.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.33 -0.396 . . . . 8.5 110.483 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 4.8 t -125.88 141.11 46.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.077 -0.511 . . . . 6.5 109.973 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -73.68 159.81 32.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.899 0.381 . . . . 7.1500000000000004 110.222 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 35.8 m80 -69.28 -10.34 57.39 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.088 -0.506 . . . . 9.4100000000000001 112.036 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . 0.692 ' HG2' ' HD2' ' B' ' 9' ' ' PRO . 60.9 mtm180 -67.1 -20.06 65.73 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.429 0.529 . . . . 9.7599999999999998 112.429 -179.202 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 32.1 p -59.75 -29.86 68.45 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.144 0.424 . . . . 11.56 112.144 -178.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . 0.676 HG12 HE22 ' B' ' 36' ' ' GLN . 21.8 t -61.94 -37.57 78.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.216 -0.447 . . . . 14.01 112.059 -178.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -91.85 -12.65 33.05 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.019 0.438 . . . . 12.9 111.181 -179.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 16.3 m -88.14 -64.71 1.1 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.252 -0.431 . . . . 12.34 111.368 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' VAL . . . . . 0.462 HG23 ' H ' ' B' ' 35' ' ' TYR . 6.9 m -108.64 -13.0 10.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.755 0.312 . . . . 13.869999999999999 111.614 -179.215 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' GLY . . . . . 0.432 ' HA2' ' O ' ' B' ' 30' ' ' VAL . . . 89.65 -12.68 66.32 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.573 -0.822 . . . . 14.369999999999999 112.003 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' TYR . . . . . 0.462 ' H ' HG23 ' B' ' 33' ' ' VAL . 14.9 m-85 -73.12 141.2 47.49 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.682 0.277 . . . . 15.56 110.632 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . 0.676 HE22 HG12 ' B' ' 30' ' ' VAL . 34.7 mm-40 -84.64 148.65 52.31 Favored Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 108.902 -0.777 . . . . 13.859999999999999 108.902 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.702 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 52.4 Cg_exo -52.63 -39.78 74.91 Favored 'Trans proline' 0 N--CA 1.465 -0.153 0 C-N-CA 122.301 2.001 . . . . 15.210000000000001 111.986 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 26.0 mp0 -65.9 -20.24 66.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.938 -0.573 . . . . 17.82 112.22 -179.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.55 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 42.6 mt-10 -79.15 -39.35 33.74 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.892 -0.41 . . . . 14.42 109.892 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' B' ' 40' ' ' LEU . 1.5 mm? -73.41 -34.21 65.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.905 -0.589 . . . . 14.550000000000001 111.207 -179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . 0.702 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 56.6 mt -59.18 114.66 2.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.96 0.409 . . . . 14.050000000000001 111.304 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 98.32 -7.72 62.11 Favored Glycine 0 N--CA 1.45 -0.422 0 CA-C-N 115.825 -0.625 . . . . 11.68 112.44 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.467 ' HA ' ' HE2' ' B' ' 43' ' ' LYS . 1.4 mmpt? -108.47 166.68 10.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.74 0.305 . . . . 14.17 110.925 -179.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' ASN . . . . . 0.782 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 12.8 m120 -103.04 149.33 24.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.801 -0.636 . . . . 10.74 109.959 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 18.9 tt -71.48 -27.34 28.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.957 0.408 . . . . 9.8800000000000008 110.819 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 9.9 p -71.76 -20.53 20.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-O 120.986 0.422 . . . . 11.779999999999999 111.413 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . 0.782 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 41.8 mt-10 -70.52 -34.47 72.34 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.254 -0.43 . . . . 11.890000000000001 110.98 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -103.08 26.3 8.39 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.109 -0.496 . . . . 14.279999999999999 110.147 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 49.8 t -107.57 152.55 24.11 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.001 -0.545 . . . . 10.81 111.082 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' HIS . . . . . 0.434 ' HB2' ' HB2' ' B' ' 77' ' ' ARG . 8.8 t-80 -63.92 130.29 94.38 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 115.401 -0.818 . . . . 12.029999999999999 109.538 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' PRO . . . . . 0.424 ' HD2' ' CD2' ' B' ' 50' ' ' HIS . 85.9 Cg_exo -43.53 -51.18 6.28 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.606 2.871 . . . . 11.869999999999999 114.438 -179.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -72.98 -3.91 28.96 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.375 0.509 . . . . 9.2799999999999994 112.375 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . 0.58 ' HB3' ' HB2' ' B' ' 76' ' ' PHE . 14.8 m-20 -118.35 3.86 11.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.986 0.422 . . . . 7.5199999999999996 110.692 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -68.2 -48.23 65.79 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.919 -0.582 . . . . 6.5700000000000003 111.524 -178.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 49.7 tp60 -65.23 -33.49 76.12 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.858 -0.423 . . . . 6.9900000000000002 109.858 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 22.0 tp -61.38 -39.23 89.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.963 -0.562 . . . . 5.1399999999999997 109.993 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 1.1 mt -66.39 -47.47 73.23 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.786 -0.643 . . . . 6.8200000000000003 110.272 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -61.95 -46.09 90.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.807 -0.633 . . . . 8.6899999999999995 111.036 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -58.95 -45.68 89.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.47 . . . . 6.46 111.056 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 15.7 m -66.84 -36.4 82.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.247 -0.433 . . . . 5.5899999999999999 110.869 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' PHE . . . . . 0.617 ' O ' HG12 ' B' ' 64' ' ' VAL . 1.7 m-30 -64.64 -42.8 95.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.732 0.301 . . . . 8.3300000000000001 110.539 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -65.17 -28.75 69.62 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.079 0.466 . . . . 7.1500000000000004 110.405 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -76.82 -37.86 54.94 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.993 -0.549 . . . . 9.5299999999999994 111.021 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.718 ' HA ' HD12 ' B' ' 67' ' ' LEU . 2.8 p -65.74 -27.46 41.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 CA-C-O 120.775 0.321 . . . . 8.2200000000000006 110.474 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . 0.437 HG23 ' O ' ' B' ' 61' ' ' PHE . 92.4 t -69.77 -34.77 62.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.327 0.585 . . . . 7.4299999999999997 109.605 178.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -80.27 -18.26 49.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.636 -0.711 . . . . 10.52 110.439 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.817 ' HB3' ' HB2' ' B' ' 70' ' ' GLN . 64.8 mt -74.3 -46.92 38.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.862 -0.608 . . . . 7.5300000000000002 110.572 179.326 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 86.2 mttt 56.6 88.46 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.85 0.719 . . . . 8.0099999999999998 112.538 179.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.55 -4.0 63.73 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.431 -0.89 . . . . 5.8700000000000001 112.533 178.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . 0.817 ' HB2' ' HB3' ' B' ' 67' ' ' LEU . 2.3 mp0 -104.68 141.53 36.28 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 110.164 -0.31 . . . . 5.6299999999999999 110.164 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' VAL . . . . . 0.82 ' HB ' ' HD1' ' B' ' 93' ' ' PHE . 7.1 p -92.94 132.33 37.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.151 0.5 . . . . 6.0599999999999996 111.054 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 14.9 tp -119.98 111.73 18.28 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.917 -0.583 . . . . 4.9299999999999997 109.435 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' SER . . . . . 0.62 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.2 p -91.24 110.29 21.57 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.208 -0.451 . . . . 6.79 110.926 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.1 p -103.83 128.69 56.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.122 -0.49 . . . . 4.4199999999999999 110.107 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 28.4 ttt -99.29 109.11 21.78 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.366 -0.379 . . . . 5.6699999999999999 110.292 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.58 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 51.5 p90 -138.6 -173.64 3.61 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.058 -0.519 . . . . 3.75 110.121 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' ARG . . . . . 0.434 ' HB2' ' HB2' ' B' ' 50' ' ' HIS . 26.3 mtt180 -106.64 115.61 30.49 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.754 0.311 . . . . 7.3499999999999996 110.32 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -102.64 149.45 24.43 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.035 -0.53 . . . . 5.79 110.021 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' ARG . . . . . 0.581 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 17.5 ttp180 -88.88 133.06 34.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.925 0.393 . . . . 11.529999999999999 110.618 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' SER . . . . . 0.496 ' HG ' ' HG2' ' B' ' 84' ' ' GLU . 91.0 p -94.58 -176.33 3.88 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.683 -0.488 . . . . 7.4699999999999998 109.683 178.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . 0.416 ' HA ' ' HD2' ' B' ' 81' ' ' LYS . 40.2 tptt -68.26 -16.22 63.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.27 0.557 . . . . 12.67 110.014 179.077 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -88.11 -0.54 57.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.678 -0.692 . . . . 9.25 109.884 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 65.93 28.78 10.54 Favored 'General case' 0 C--N 1.334 -0.076 0 CA-C-N 115.551 -0.75 . . . . 8.75 110.795 -179.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . 0.496 ' HG2' ' HG ' ' B' ' 80' ' ' SER . 12.2 pt-20 -106.53 163.72 12.65 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.031 -0.729 . . . . 6.8700000000000001 109.031 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . 0.581 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 49.9 m95 -105.15 127.76 53.06 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.135 0.493 . . . . 8.3800000000000008 111.426 -179.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -129.26 151.3 50.06 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.792 -0.64 . . . . 7.25 109.814 179.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 87' ' ' TRP . . . . . 0.534 ' HD1' ' HB2' ' B' ' 114' ' ' LYS . 98.8 m95 -75.65 111.57 11.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.358 0.599 . . . . 9.3000000000000007 110.511 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 88' ' ' MET . . . . . 0.415 ' SD ' ' HB3' ' B' ' 110' ' ' ASN . 47.0 tpp -116.0 123.44 48.01 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.248 -0.887 . . . . 4.46 110.722 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 33.3 ttp180 -97.76 83.27 3.16 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.592 -0.892 . . . . 7.3099999999999996 108.592 178.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 90' ' ' THR . . . . . 0.628 HG22 ' HB3' ' B' ' 108' ' ' CYS . 36.2 m -72.06 109.45 5.87 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.418 -0.81 . . . . 6.1799999999999997 111.231 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 91' ' ' SER . . . . . 0.666 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 1.9 m -90.38 87.89 6.97 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.697 -0.683 . . . . 6.4500000000000002 109.339 179.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 92' ' ' SER . . . . . 0.418 ' HA ' ' HA ' ' B' ' 108' ' ' CYS . 9.2 m -75.39 120.46 20.87 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.84 -0.618 . . . . 6.75 111.517 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . 0.82 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 55.8 t80 -116.88 124.22 48.94 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.943 -0.572 . . . . 6.4500000000000002 110.085 179.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 94' ' ' THR . . . . . 0.515 HG23 HG21 ' B' ' 103' ' ' ILE . 0.3 OUTLIER -83.69 103.26 12.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.881 0.372 . . . . 9.8800000000000008 110.691 179.76 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . 0.467 ' CZ ' ' HB ' ' A' ' 13' ' ' ILE . 0.0 OUTLIER -74.62 117.17 16.15 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.156 -0.474 . . . . 8.9100000000000001 110.52 -179.647 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -83.25 116.91 22.62 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.751 -0.659 . . . . 10.99 110.584 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 97' ' ' ASN . . . . . 0.489 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 62.7 t30 -80.74 127.84 73.83 Favored Pre-proline 0 C--N 1.322 -0.625 0 N-CA-C 109.251 -0.648 . . . . 8.5099999999999998 109.251 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . 0.489 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 23.5 Cg_endo -62.32 73.27 0.11 Allowed 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.257 2.638 . . . . 9.1600000000000001 113.054 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . 0.494 ' HB3' ' H ' ' B' ' 100' ' ' SER . 3.6 m-85 -147.4 -137.58 0.09 Allowed 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.818 -0.808 . . . . 11.390000000000001 108.818 179.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 100' ' ' SER . . . . . 0.494 ' H ' ' HB3' ' B' ' 99' ' ' TYR . 0.3 OUTLIER -80.54 49.3 1.15 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.665 0.269 . . . . 7.9000000000000004 110.968 179.437 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 38.8 t70 50.53 77.0 0.13 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.719 -0.673 . . . . 9.0800000000000001 111.101 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . 0.433 ' HG3' ' HB3' ' B' ' 97' ' ' ASN . 3.4 pt-20 -133.43 151.46 51.8 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.946 0.403 . . . . 7.71 111.459 -179.143 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' ILE . . . . . 0.515 HG21 HG23 ' B' ' 94' ' ' THR . 40.2 mt -94.9 98.3 7.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.638 -0.71 . . . . 8.3800000000000008 109.146 178.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -58.45 -47.8 82.8 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.985 -0.552 . . . . 8.8100000000000005 110.723 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 8.1 p90 -161.31 163.49 30.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.104 -0.498 . . . . 7.8200000000000003 110.133 179.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 62.6 mt -105.16 114.32 44.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.896 -0.593 . . . . 7.2199999999999998 109.686 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . 0.677 HG21 HG21 ' B' ' 13' ' ' ILE . 88.1 mt -86.87 104.21 13.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.008 -0.542 . . . . 6.7199999999999998 109.697 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' CYS . . . . . 0.628 ' HB3' HG22 ' B' ' 90' ' ' THR . 75.6 m -94.43 108.49 20.41 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.967 -0.561 . . . . 5.3099999999999996 111.632 -179.179 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' THR . . . . . 0.666 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 27.5 m -82.47 90.94 6.79 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.94 -0.763 . . . . 5.8700000000000001 108.94 177.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' ASN . . . . . 0.468 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.0 m-20 -72.24 106.86 4.59 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.836 -0.62 . . . . 6.9000000000000004 111.363 -178.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 1.4 m -108.72 109.03 20.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.308 -0.406 . . . . 8.9000000000000004 110.189 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -70.95 127.07 31.35 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.987 0.422 . . . . 11.84 110.586 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . 0.403 HG11 ' HG3' ' B' ' 114' ' ' LYS . 35.2 t -100.23 -55.46 5.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.769 -0.65 . . . . 12.4 109.751 179.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . 0.534 ' HB2' ' HD1' ' B' ' 87' ' ' TRP . 45.4 mtpt . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.516 -0.754 . . . . 12.68 109.703 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 80.0 m . . . . . 0 N--CA 1.477 0.925 0 N-CA-C 110.328 -0.249 . . . . 15.82 110.328 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.7 mm-40 -101.39 106.95 48.64 Favored Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 109.689 -0.485 . . . . 15.44 109.689 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.65 164.85 34.41 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.769 2.312 . . . . 14.109999999999999 112.556 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.698 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.2 OUTLIER -82.89 52.0 2.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.154 0.502 . . . . 11.369999999999999 110.975 179.737 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.411 ' HB2' HG21 ' A' ' 111' ' ' THR . 40.2 tt0 -156.41 129.97 8.26 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.782 -0.645 . . . . 10.59 109.479 -179.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.929 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 39.4 p90 -144.83 145.11 31.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.937 0.399 . . . . 9.1999999999999993 111.425 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.496 HG21 HG21 ' A' ' 107' ' ' ILE . 2.5 mp -93.57 117.93 38.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 109.795 -0.446 . . . . 8.9399999999999995 109.795 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 52.8 p -105.16 121.97 44.94 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.233 0.539 . . . . 6.1100000000000003 111.057 -179.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.9 mtp180 -97.85 102.9 14.77 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.303 -0.999 . . . . 9.4600000000000009 108.303 178.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 31.8 p80 -130.46 153.85 48.36 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.511 -0.313 . . . . 10.369999999999999 110.931 -178.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -69.18 173.98 5.1 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.475 -0.329 . . . . 13.279999999999999 110.236 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.0 pt -58.83 -29.51 40.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 112.802 0.667 . . . . 13.970000000000001 112.802 -178.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -73.94 -21.38 60.06 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.887 0.375 . . . . 13.85 111.465 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 112.12 -0.93 26.92 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 120.436 -0.888 . . . . 9.6099999999999994 112.509 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.42 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 40.2 mm -72.98 118.45 18.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.679 -0.489 . . . . 11.289999999999999 109.679 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.406 ' CG ' ' HB3' ' A' ' 40' ' ' LEU . 86.9 m-85 -69.41 113.63 6.89 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.183 -0.462 . . . . 10.449999999999999 111.507 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.83 -35.95 23.85 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.355 0.598 . . . . 8.1300000000000008 109.659 178.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -152.78 125.85 8.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.312 -0.858 . . . . 7.4900000000000002 108.985 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.606 HG21 ' HB2' ' A' ' 40' ' ' LEU . 2.5 t -110.35 147.88 14.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.953 0.406 . . . . 6.4500000000000002 111.414 -178.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.929 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 6.4 t70 -68.81 168.9 12.46 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.874 -0.603 . . . . 7.3099999999999996 109.764 179.145 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 60.5 m170 -95.34 -11.96 26.9 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.995 0.426 . . . . 12.41 110.574 -179.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 85.6 mtm180 -82.0 -5.94 58.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.895 -0.593 . . . . 12.19 111.947 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.6 p -60.88 -27.37 68.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.867 0.365 . . . . 13.5 111.163 -179.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.492 HG12 HE22 ' A' ' 36' ' ' GLN . 15.0 t -65.14 -32.67 59.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.045 -0.525 . . . . 16.559999999999999 110.823 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.52 -27.19 21.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.182 -0.463 . . . . 15.07 110.787 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.561 ' HA ' HG21 ' A' ' 10' ' ' THR . 4.0 m -76.63 -55.37 5.57 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.114 -0.494 . . . . 15.26 111.376 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.551 HG13 ' HD2' ' A' ' 78' ' ' PHE . 2.7 m -120.13 -30.07 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 111.871 0.322 . . . . 14.18 111.871 -179.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.431 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 110.48 -23.57 19.91 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.307 -0.949 . . . . 13.85 112.015 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -65.58 135.86 55.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.743 0.306 . . . . 18.59 110.529 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.63 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 48.7 mm-40 -77.3 150.41 80.11 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 109.16 -0.682 . . . . 15.890000000000001 109.16 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.573 ' HB3' ' HB ' ' A' ' 25' ' ' VAL . 53.6 Cg_exo -52.36 -40.0 71.82 Favored 'Trans proline' 0 CA--C 1.528 0.202 0 C-N-CA 122.443 2.095 . . . . 12.26 112.05 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.557 ' HA ' HD12 ' A' ' 41' ' ' LEU . 25.7 mp0 -65.6 -20.34 66.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.621 -0.718 . . . . 13.68 111.612 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.63 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 29.3 mt-10 -78.74 -28.14 44.89 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.146 -0.316 . . . . 17.34 110.146 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.606 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.7 mm? -86.58 -26.9 24.23 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.879 -0.601 . . . . 13.56 110.791 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.557 HD12 ' HA ' ' A' ' 38' ' ' GLN . 96.7 mt -60.43 119.34 7.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.106 -0.497 . . . . 13.42 110.824 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.9 3.8 82.8 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 121.01 -0.614 . . . . 13.390000000000001 112.41 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.498 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 8.3 mmpt? -113.95 161.2 17.95 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.224 -0.287 . . . . 17.239999999999998 110.224 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.633 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 16.8 m120 -98.06 136.37 38.41 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.669 -0.493 . . . . 12.77 109.669 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.479 HD12 ' HZ ' ' A' ' 61' ' ' PHE . 13.8 tt -58.8 -27.55 35.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.106 0.479 . . . . 12.050000000000001 110.992 179.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.2 p -71.21 -18.68 20.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.051 -0.522 . . . . 13.390000000000001 111.56 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.633 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.0 mt-10 -71.14 -34.63 71.21 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.035 0.445 . . . . 16.530000000000001 110.901 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 30.7 m-85 -100.45 24.14 9.31 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.903 -0.59 . . . . 15.83 110.471 -179.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 46.0 t -110.57 150.19 29.3 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.059 -0.519 . . . . 12.01 110.063 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.522 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 6.8 t-160 -58.33 125.17 74.51 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 109.133 -0.691 . . . . 15.130000000000001 109.133 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_exo -45.63 -46.36 15.04 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 123.189 2.592 . . . . 15.83 113.679 -179.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -75.82 0.03 19.48 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.121 0.415 . . . . 16.690000000000001 112.121 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.522 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 9.5 m-20 -122.03 -0.17 9.54 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.963 0.411 . . . . 13.16 110.246 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -63.9 -45.47 89.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.791 -0.64 . . . . 16.170000000000002 111.557 -179.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.7 tp60 -66.46 -37.0 84.18 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.433 -0.58 . . . . 14.35 109.433 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.8 tp -59.48 -42.1 91.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.727 -0.67 . . . . 12.51 109.445 178.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.404 HD22 ' HA ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -67.73 -51.24 51.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.521 -0.763 . . . . 10.08 110.327 179.159 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -57.29 -47.22 82.03 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.767 -0.651 . . . . 11.710000000000001 111.606 -179.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.464 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 31.3 t70 -58.96 -45.89 89.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.32 -0.4 . . . . 9.7100000000000009 110.983 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.4 m -65.87 -33.27 75.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.966 -0.561 . . . . 9.5199999999999996 111.022 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.592 ' O ' HG12 ' A' ' 64' ' ' VAL . 1.9 m-85 -62.88 -39.47 94.54 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.051 0.453 . . . . 12.109999999999999 110.163 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -70.22 -32.0 69.68 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.043 -0.526 . . . . 10.289999999999999 110.092 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.628 ' HA ' ' HD3' ' A' ' 66' ' ' LYS . 65.7 mt-30 -66.08 -39.02 89.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.95 -0.568 . . . . 10.619999999999999 111.219 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.592 HG12 ' O ' ' A' ' 61' ' ' PHE . 2.3 p -68.14 -25.38 31.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.854 0.359 . . . . 10.93 110.687 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.415 ' O ' ' HG3' ' A' ' 68' ' ' LYS . 86.6 t -73.6 -34.82 42.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 N-CA-C 109.157 -0.683 . . . . 12.890000000000001 109.157 178.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.628 ' HD3' ' HA ' ' A' ' 63' ' ' GLN . 45.3 mtpt -72.23 -38.99 68.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.518 -0.765 . . . . 16.68 109.634 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.49 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 65.9 mt -66.01 -53.49 38.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.296 -0.865 . . . . 13.18 111.034 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.415 ' HG3' ' O ' ' A' ' 65' ' ' VAL . 62.7 mttt 60.33 91.46 0.05 Allowed 'General case' 0 N--CA 1.466 0.326 0 O-C-N 123.658 0.599 . . . . 15.17 112.38 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 105.74 -13.6 46.15 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.726 -0.75 . . . . 10.01 112.804 179.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.49 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 6.3 tp-100 -96.67 126.25 41.7 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.269 -0.271 . . . . 10.039999999999999 110.269 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.444 ' HA ' ' O ' ' A' ' 92' ' ' SER . 2.4 p -80.75 112.93 19.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.333 0.587 . . . . 8.5399999999999991 110.587 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.3 tp -104.29 117.33 33.94 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.616 -0.72 . . . . 8.1300000000000008 110.398 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.76 106.93 18.39 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.863 -0.608 . . . . 7.8899999999999997 111.193 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.445 HG12 ' HB ' ' A' ' 90' ' ' THR . 2.6 p -101.28 122.98 54.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.112 0.482 . . . . 8.1799999999999997 109.867 179.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 23.6 ttt -99.78 118.42 36.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.243 -0.435 . . . . 9.6999999999999993 110.954 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.592 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 45.4 p90 -145.9 -171.65 3.75 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.663 -0.699 . . . . 10.27 109.279 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.44 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 44.9 mtm180 -110.55 120.12 41.39 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.055 0.455 . . . . 13.859999999999999 110.398 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.592 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 12.7 t80 -102.25 151.88 21.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.316 -0.856 . . . . 9.7300000000000004 110.15 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.484 ' HA ' ' O ' ' A' ' 84' ' ' GLU . 37.9 ttp180 -88.61 128.16 35.58 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.171 -0.468 . . . . 11.300000000000001 110.471 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.46 ' HA ' ' HB ' ' A' ' 33' ' ' VAL . 54.9 p -88.47 -176.25 5.25 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.299 -0.41 . . . . 11.039999999999999 110.025 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.4 tptt -72.33 -14.23 61.69 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.104 -0.702 . . . . 13.18 109.104 178.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -90.74 1.38 56.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.316 -0.856 . . . . 14.890000000000001 109.489 178.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 67.82 22.91 8.63 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.207 -0.906 . . . . 12.92 111.316 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.484 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.5 pt-20 -96.1 167.95 10.9 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.755 -0.461 . . . . 10.94 109.755 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.466 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 77.2 m95 -108.92 108.31 19.02 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.582 -0.281 . . . . 11.77 110.562 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.502 HD21 HG12 ' A' ' 33' ' ' VAL . 2.6 pp -110.0 151.09 27.58 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.488 -0.324 . . . . 11.57 110.365 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.55 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 96.9 m95 -77.59 119.66 21.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.039 0.447 . . . . 10.73 110.527 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.437 ' SD ' ' HB3' ' A' ' 110' ' ' ASN . 30.5 tpp -119.2 135.41 54.69 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.776 -0.647 . . . . 9.7400000000000002 111.063 -178.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -104.72 81.69 1.8 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.65 -0.87 . . . . 11.16 108.65 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.587 HG22 ' HB3' ' A' ' 108' ' ' CYS . 28.7 m -71.38 109.51 5.41 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.689 -0.687 . . . . 9.5899999999999999 111.963 -178.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.493 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 0.7 OUTLIER -87.51 93.42 9.41 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.431 -0.804 . . . . 8.8800000000000008 108.982 178.697 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.444 ' O ' ' HA ' ' A' ' 71' ' ' VAL . 16.4 m -81.91 124.02 29.35 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.04 0.448 . . . . 8.9399999999999995 111.452 -178.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -125.63 125.06 42.52 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.746 -0.661 . . . . 12.1 109.93 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.69 129.51 37.22 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.297 -0.411 . . . . 10.16 111.474 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -114.04 109.97 19.29 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.376 -0.375 . . . . 12.6 110.079 179.496 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.55 152.91 28.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.997 0.427 . . . . 14.6 110.966 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -92.37 145.87 31.43 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 109.15 -0.685 . . . . 13.83 109.15 178.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.15 28.61 0.36 Allowed 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 122.65 2.233 . . . . 15.34 113.288 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -98.7 -64.69 1.01 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.145 0.498 . . . . 16.890000000000001 110.001 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.42 ' HB2' ' HG3' ' A' ' 102' ' ' GLU . 49.5 m -133.24 17.98 4.06 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.686 -0.688 . . . . 15.140000000000001 109.648 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.9 t70 63.62 34.16 12.62 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.272 -0.877 . . . . 14.94 109.811 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.42 ' HG3' ' HB2' ' A' ' 100' ' ' SER . 0.1 OUTLIER -80.3 130.22 35.04 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.181 -0.918 . . . . 12.949999999999999 110.154 -179.796 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 36.7 mt -81.15 106.74 12.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.872 -0.418 . . . . 11.44 109.872 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -70.58 -43.81 68.65 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.728 0.299 . . . . 11.65 110.328 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 31.6 p90 -165.5 172.4 12.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.211 -0.449 . . . . 10.35 110.295 178.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 52.1 mt -110.86 122.76 65.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.106 -0.497 . . . . 10.470000000000001 110.529 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.496 HG21 HG21 ' A' ' 13' ' ' ILE . 87.4 mt -84.56 110.72 19.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.311 -0.626 . . . . 9.3200000000000003 109.311 179.163 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.587 ' HB3' HG22 ' A' ' 90' ' ' THR . 64.5 m -110.79 109.37 19.56 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.143 0.497 . . . . 10.15 111.505 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.679 HG23 HG13 ' B' ' 13' ' ' ILE . 22.5 m -83.78 100.01 10.65 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.823 -0.806 . . . . 11.4 108.823 178.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.437 ' HB3' ' SD ' ' A' ' 88' ' ' MET . 6.0 m-20 -84.68 101.57 12.28 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.989 -0.55 . . . . 11.640000000000001 111.549 -178.373 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.411 HG21 ' HB2' ' A' ' 11' ' ' GLU . 2.5 m -103.87 121.1 42.37 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.98 -0.555 . . . . 11.220000000000001 109.791 178.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . 0.698 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 6.3 t-20 -75.87 125.26 28.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.939 0.4 . . . . 12.98 110.826 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 61.7 t -98.55 -49.47 11.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.728 -0.669 . . . . 15.109999999999999 109.929 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.55 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 52.1 mtpt . . . . . 0 C--O 1.252 1.194 0 CA-C-O 118.483 -0.77 . . . . 16.32 110.388 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 72.4 m . . . . . 0 N--CA 1.477 0.88 0 CA-C-O 120.871 0.367 . . . . 7.8399999999999999 110.23 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' GLN . . . . . 0.532 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 71.6 mm-40 -95.08 142.3 24.42 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.026 -0.534 . . . . 7.4900000000000002 110.997 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' B' ' 8' ' ' GLN . 10.8 Cg_exo -72.87 171.99 16.29 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 123.099 2.533 . . . . 6.4400000000000004 111.757 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.91 56.48 3.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.312 0.577 . . . . 5.9800000000000004 111.082 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.624 ' HA ' ' O ' ' B' ' 110' ' ' ASN . 0.0 OUTLIER -162.85 141.74 8.69 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.399 -0.963 . . . . 5.8499999999999996 108.399 179.722 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -152.47 165.73 34.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.334 0.588 . . . . 6.4900000000000002 112.274 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . 0.679 HG13 HG23 ' A' ' 109' ' ' THR . 9.1 mm -90.57 118.07 35.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 114.857 -1.065 . . . . 6.0199999999999996 110.329 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.636 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.7 OUTLIER -106.31 94.49 5.18 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.773 -0.649 . . . . 5.3700000000000001 110.293 179.639 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . 0.562 ' HG2' HG12 ' B' ' 107' ' ' ILE . 55.8 mtp180 -87.58 101.89 14.06 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.273 -0.64 . . . . 9.4600000000000009 109.273 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . 0.423 ' O ' ' HB2' ' B' ' 105' ' ' TYR . 35.0 p80 -132.21 162.07 31.85 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.132 -0.486 . . . . 8.3100000000000005 110.551 -179.064 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -83.17 177.91 8.34 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.517 -0.311 . . . . 11.19 110.291 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 26.6 pt -60.91 -20.88 22.8 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 113.24 0.83 . . . . 9.3699999999999992 113.24 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -83.69 -14.42 51.8 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.196 0.522 . . . . 11.92 110.601 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 104.14 -6.34 46.72 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.486 -0.864 . . . . 8.6799999999999997 111.901 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . 0.533 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 26.9 mm -70.03 117.21 12.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 110.021 -0.362 . . . . 11.16 110.021 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . 0.636 ' HE1' ' HB3' ' B' ' 14' ' ' SER . 97.0 m-85 -73.4 133.07 43.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.201 0.524 . . . . 8.5999999999999996 111.829 -179.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -103.89 -35.3 8.2 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.479 -0.782 . . . . 7.9100000000000001 110.018 178.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -148.04 129.55 14.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.794 -0.639 . . . . 8.5 110.246 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . 0.552 HG21 ' HB2' ' B' ' 40' ' ' LEU . 12.4 t -124.23 126.49 72.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.479 -0.563 . . . . 6.5 109.479 179.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -67.76 156.06 37.86 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.975 0.416 . . . . 7.1500000000000004 110.765 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -62.59 -19.21 63.51 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.842 -0.617 . . . . 9.4100000000000001 112.2 -178.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . 0.532 ' HG2' ' HB3' ' B' ' 8' ' ' GLN . 70.3 mtm180 -64.78 -16.73 63.42 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.839 0.311 . . . . 9.7599999999999998 111.839 -179.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 30.3 p -60.77 -32.62 71.93 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 120.872 0.368 . . . . 11.56 111.099 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . 0.612 HG12 HE22 ' B' ' 36' ' ' GLN . 18.1 t -64.51 -36.22 76.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 14.01 111.076 -179.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.49 -19.13 31.67 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.985 0.422 . . . . 12.9 110.811 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 20.1 m -84.52 -57.93 2.94 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.152 -0.476 . . . . 12.34 111.889 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' VAL . . . . . 0.467 HG13 ' HD2' ' B' ' 78' ' ' PHE . 6.2 m -122.24 -5.01 8.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 N-CA-C 112.373 0.509 . . . . 13.869999999999999 112.373 -178.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.86 -18.21 36.51 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.471 -0.871 . . . . 14.369999999999999 112.962 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -67.05 136.96 56.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.734 0.302 . . . . 15.56 110.919 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . 0.624 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 33.5 mm-40 -80.57 151.65 71.83 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 109.144 -0.687 . . . . 13.859999999999999 109.144 178.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.507 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 74.5 Cg_exo -50.61 -44.31 40.95 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.845 2.363 . . . . 15.210000000000001 112.864 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -65.11 -24.95 67.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.079 -0.509 . . . . 17.82 112.164 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.624 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 30.6 mt-10 -69.19 -25.82 64.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.805 0.336 . . . . 14.42 111.061 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.552 ' HB2' HG21 ' B' ' 25' ' ' VAL . 2.2 mm? -94.84 -21.27 18.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.226 -0.443 . . . . 14.550000000000001 110.873 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 52.5 mt -61.87 119.24 8.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.217 -0.447 . . . . 14.050000000000001 110.826 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 82.14 10.07 84.29 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.862 -0.685 . . . . 11.68 112.511 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.671 ' HA ' ' HE2' ' B' ' 43' ' ' LYS . 8.7 mmpt? -117.0 156.24 27.82 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 110.153 -0.314 . . . . 14.17 110.153 179.761 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' ASN . . . . . 0.715 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 13.5 m120 -93.29 135.93 34.04 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.153 -0.476 . . . . 10.74 109.91 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . 0.405 ' HB ' ' CZ ' ' B' ' 22' ' ' PHE . 15.4 tt -59.71 -26.27 34.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.285 0.564 . . . . 9.8800000000000008 110.847 178.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 9.8 p -71.17 -22.05 22.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.844 -0.616 . . . . 11.779999999999999 111.243 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . 0.715 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 44.2 mt-10 -70.63 -30.04 66.58 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.968 0.413 . . . . 11.890000000000001 110.668 -179.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -105.37 21.06 17.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.933 -0.576 . . . . 14.279999999999999 110.447 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 53.4 t -104.52 151.98 22.93 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 116.004 -0.544 . . . . 10.81 110.411 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' HIS . . . . . 0.423 ' CD2' ' HD2' ' B' ' 51' ' ' PRO . 10.4 t-80 -61.61 126.54 87.03 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.817 -0.629 . . . . 12.029999999999999 109.542 178.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' PRO . . . . . 0.423 ' HD2' ' CD2' ' B' ' 50' ' ' HIS . 76.0 Cg_exo -42.55 -50.32 5.85 Favored 'Trans proline' 0 CA--C 1.533 0.439 0 C-N-CA 123.62 2.88 . . . . 11.869999999999999 114.143 -179.354 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -75.98 2.98 11.19 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.649 0.611 . . . . 9.2799999999999994 112.649 -179.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -126.27 3.26 7.07 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.997 0.427 . . . . 7.5199999999999996 110.841 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -67.6 -37.55 82.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.822 -0.626 . . . . 6.5700000000000003 110.692 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 47.8 tp60 -65.86 -40.84 92.07 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.994 -0.743 . . . . 6.9900000000000002 108.994 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . 0.496 HD23 ' HB3' ' B' ' 76' ' ' PHE . 32.1 tp -57.2 -45.07 84.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.132 -0.94 . . . . 5.1399999999999997 110.713 178.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . 0.423 ' HA ' HD21 ' B' ' 57' ' ' LEU . 1.0 OUTLIER -61.02 -50.33 73.78 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.053 -0.521 . . . . 6.8200000000000003 110.739 179.645 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 55.3 ttt180 -59.82 -45.39 92.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.783 -0.644 . . . . 8.6899999999999995 110.925 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -62.0 -45.32 94.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.926 -0.579 . . . . 6.46 110.985 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 23.4 m -63.33 -37.85 88.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.219 -0.446 . . . . 5.5899999999999999 110.684 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' PHE . . . . . 0.482 ' O ' HG12 ' B' ' 64' ' ' VAL . 4.3 m-30 -65.08 -41.0 95.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.379 -0.373 . . . . 8.3300000000000001 110.411 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -63.9 -39.02 93.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.98 0.419 . . . . 7.1500000000000004 110.273 179.184 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.428 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 39.2 mt-30 -69.11 -40.48 78.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.976 -0.556 . . . . 9.5299999999999994 111.792 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.482 HG12 ' O ' ' B' ' 61' ' ' PHE . 4.0 p -67.19 -25.39 33.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-O 120.767 0.317 . . . . 8.2200000000000006 111.11 -179.278 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . 0.498 ' HA ' HG21 ' B' ' 94' ' ' THR . 51.7 t -69.21 -35.83 69.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 109.263 -0.643 . . . . 7.4299999999999997 109.263 178.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -70.48 -36.06 73.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.511 -0.768 . . . . 10.52 110.093 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' B' ' 63' ' ' GLN . 69.8 mt -65.56 -43.86 88.52 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.119 -0.697 . . . . 7.5300000000000002 109.119 178.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 65.9 tttt 47.29 90.57 0.02 OUTLIER 'General case' 0 C--O 1.235 0.298 0 CA-C-N 114.801 -1.09 . . . . 8.0099999999999998 112.837 178.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 108.6 1.59 32.67 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.552 -0.832 . . . . 5.8700000000000001 112.334 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -114.94 165.34 12.97 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.986 -0.376 . . . . 5.6299999999999999 109.986 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 6.6 t -108.14 127.13 64.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.067 0.461 . . . . 6.0599999999999996 111.118 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 42.0 tp -119.52 103.11 9.14 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.567 -0.742 . . . . 4.9299999999999997 109.062 178.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' SER . . . . . 0.589 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.3 p -86.64 112.59 21.76 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.046 -0.525 . . . . 6.79 111.228 -179.412 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 p -107.04 127.16 62.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.704 -0.68 . . . . 4.4199999999999999 109.927 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 28.7 ttt -100.54 110.33 22.49 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.08 0.467 . . . . 5.6699999999999999 110.815 -179.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.496 ' HB3' HD23 ' B' ' 56' ' ' LEU . 51.9 p90 -137.14 -173.16 3.38 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.729 -0.669 . . . . 3.75 109.368 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' ARG . . . . . 0.463 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 50.6 mtm180 -105.15 119.48 39.16 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.148 0.499 . . . . 7.3499999999999996 110.507 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . 0.467 ' HD2' HG13 ' B' ' 33' ' ' VAL . 16.8 t80 -102.49 148.84 25.03 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.2 -0.909 . . . . 5.79 110.339 -179.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' ARG . . . . . 0.643 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 3.6 ttp180 -90.06 124.27 34.64 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.205 -0.452 . . . . 11.529999999999999 110.185 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' SER . . . . . 0.516 ' HB3' HD21 ' B' ' 86' ' ' LEU . 95.0 p -91.52 -175.23 4.14 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.579 -0.526 . . . . 7.4699999999999998 109.579 178.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -65.16 -16.6 63.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.113 0.482 . . . . 12.67 110.479 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -89.23 -0.22 57.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.13 -0.486 . . . . 9.25 110.458 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 69.16 12.59 8.53 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.7 -0.682 . . . . 8.75 111.678 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -89.96 154.85 19.53 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.937 -0.394 . . . . 6.8700000000000001 109.937 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . 0.643 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 57.2 m95 -97.86 108.48 21.2 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.31 -0.405 . . . . 8.3800000000000008 111.371 -178.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . 0.516 HD21 ' HB3' ' B' ' 80' ' ' SER . 1.9 pp -109.31 147.52 32.54 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.071 -0.513 . . . . 7.25 110.176 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 87' ' ' TRP . . . . . 0.774 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 87.3 m95 -77.74 118.66 20.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.106 0.479 . . . . 9.3000000000000007 110.231 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 7.3 tpp -123.32 135.07 54.02 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.589 -0.732 . . . . 4.46 111.319 -178.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 37.5 ttp180 -96.17 89.55 5.18 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.633 -0.877 . . . . 7.3099999999999996 108.633 178.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 90' ' ' THR . . . . . 0.673 HG22 ' HB3' ' B' ' 108' ' ' CYS . 27.4 m -78.29 104.01 8.6 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.867 -0.606 . . . . 6.1799999999999997 111.111 -179.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 91' ' ' SER . . . . . 0.589 ' HA ' ' HA ' ' B' ' 73' ' ' SER . 1.8 m -85.63 91.0 8.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.875 -0.602 . . . . 6.4500000000000002 109.707 179.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 9.3 m -78.53 122.22 25.6 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.814 -0.63 . . . . 6.75 111.58 -178.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -122.09 121.74 37.64 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.095 -0.502 . . . . 6.4500000000000002 110.082 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 94' ' ' THR . . . . . 0.498 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.1 OUTLIER -82.23 110.25 17.25 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.449 -0.341 . . . . 9.8800000000000008 110.395 179.483 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.68 126.51 30.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.138 0.494 . . . . 8.9100000000000001 110.552 -179.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -96.26 119.05 34.03 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.555 -0.748 . . . . 10.99 110.446 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 97' ' ' ASN . . . . . 0.416 ' HB3' ' OE1' ' B' ' 102' ' ' GLU . 52.3 t30 -68.44 126.04 92.29 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.184 -0.673 . . . . 8.5099999999999998 109.184 178.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.48 4.5 2.46 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 123.095 2.53 . . . . 9.1600000000000001 114.084 -178.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -86.34 -70.56 0.6 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.843 0.354 . . . . 11.390000000000001 111.483 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -129.85 27.07 5.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.604 -0.271 . . . . 7.9000000000000004 111.039 -179.496 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 33.8 t70 60.36 49.29 7.09 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.585 0.707 . . . . 9.0800000000000001 110.215 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . 0.416 ' OE1' ' HB3' ' B' ' 97' ' ' ASN . 3.3 mp0 -97.8 153.92 17.97 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.876 -0.602 . . . . 7.71 110.123 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 46.0 mt -95.84 96.17 5.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 109.506 -0.553 . . . . 8.3800000000000008 109.506 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -68.02 -47.83 67.37 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.995 -0.548 . . . . 8.8100000000000005 110.819 -179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' TYR . . . . . 0.423 ' HB2' ' O ' ' B' ' 16' ' ' HIS . 8.8 p90 -167.93 178.39 5.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.406 -0.361 . . . . 7.8200000000000003 110.41 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 54.0 mt -120.44 115.96 48.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.89 -0.596 . . . . 7.2199999999999998 110.093 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . 0.562 HG12 ' HG2' ' B' ' 15' ' ' ARG . 19.7 mt -91.25 119.67 38.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 109.36 -0.608 . . . . 6.7199999999999998 109.36 179.463 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' CYS . . . . . 0.673 ' HB3' HG22 ' B' ' 90' ' ' THR . 71.4 m -111.43 117.88 34.28 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.909 0.385 . . . . 5.3099999999999996 111.812 -179.329 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' THR . . . . . 0.574 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 28.9 m -81.54 97.75 7.97 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.965 -1.124 . . . . 5.8700000000000001 107.965 177.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' ASN . . . . . 0.624 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.5 m-20 -79.39 102.1 8.5 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.708 -0.678 . . . . 6.9000000000000004 110.906 -178.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.04 113.25 26.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.261 -0.427 . . . . 8.9000000000000004 110.61 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -68.89 132.42 46.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.82 0.343 . . . . 11.84 110.558 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . 0.405 HG13 ' HG3' ' B' ' 114' ' ' LYS . 52.7 t -111.8 -46.18 5.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.987 -0.552 . . . . 12.4 110.239 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . 0.774 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 59.4 mtpt . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.568 -0.729 . . . . 12.68 109.927 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 57.8 m . . . . . 0 N--CA 1.477 0.92 0 N-CA-C 109.903 -0.406 . . . . 15.82 109.903 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.521 ' HB2' ' CB ' ' A' ' 31' ' ' ALA . 49.8 mm-40 -74.9 128.61 84.87 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 110.032 -0.359 . . . . 15.44 110.032 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.31 170.99 18.91 Favored 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 122.545 2.163 . . . . 14.109999999999999 112.332 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.588 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.1 OUTLIER -84.15 50.83 1.93 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.031 -0.531 . . . . 11.369999999999999 111.13 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.498 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 3.6 tm-20 -153.61 137.88 16.59 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.591 -0.731 . . . . 10.59 109.036 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.863 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 26.9 p90 -153.22 142.96 21.99 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.091 0.472 . . . . 9.1999999999999993 110.874 179.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 50.3 mm -82.02 120.57 33.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.795 -0.639 . . . . 8.9399999999999995 111.083 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.755 ' HB3' ' HE1' ' A' ' 22' ' ' PHE . 1.6 m -103.2 94.24 5.42 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.907 -0.588 . . . . 6.1100000000000003 110.551 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.595 ' HD3' ' HB3' ' A' ' 24' ' ' PHE . 10.5 mtp180 -85.73 97.25 10.04 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.411 -0.588 . . . . 9.4600000000000009 109.411 179.502 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 30.9 p80 -127.66 154.28 45.47 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.682 -0.69 . . . . 10.369999999999999 110.251 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.6 p-10 -73.61 178.18 4.89 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.525 -0.307 . . . . 13.279999999999999 110.427 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.6 pt -56.63 -28.95 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 112.815 0.672 . . . . 13.970000000000001 112.815 -179.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -77.57 -17.2 58.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.892 0.377 . . . . 13.85 111.399 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 105.79 -3.22 38.9 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.596 -0.811 . . . . 9.6099999999999994 112.687 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.494 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 18.2 mm -71.62 117.15 14.51 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-O 120.764 0.316 . . . . 11.289999999999999 110.687 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.755 ' HE1' ' HB3' ' A' ' 14' ' ' SER . 98.6 m-85 -69.89 125.33 26.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.131 -0.486 . . . . 10.449999999999999 110.324 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 m -109.42 -21.55 12.45 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.358 0.599 . . . . 8.1300000000000008 109.96 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.595 ' HB3' ' HD3' ' A' ' 15' ' ' ARG . 23.7 t80 -151.86 116.43 5.09 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.882 -0.784 . . . . 7.4900000000000002 108.882 178.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.596 HG22 ' HB2' ' A' ' 40' ' ' LEU . 3.0 t -109.94 153.1 11.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-O 120.854 0.359 . . . . 6.4500000000000002 110.917 -178.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.863 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 5.0 t70 -72.0 172.54 9.84 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.91 -0.587 . . . . 7.3099999999999996 110.358 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -96.83 -25.01 15.62 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.319 0.58 . . . . 12.41 109.817 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 54.3 mtm180 -76.11 -4.34 40.99 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.485 -0.779 . . . . 12.19 112.371 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.9 p -59.25 -27.71 66.05 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 120.843 0.354 . . . . 13.5 111.544 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.43 ' O ' ' HA2' ' A' ' 34' ' ' GLY . 24.4 t -62.57 -34.94 67.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.98 -0.555 . . . . 16.559999999999999 110.923 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.521 ' CB ' ' HB2' ' A' ' 8' ' ' GLN . . . -93.48 -6.28 47.25 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.875 0.369 . . . . 15.07 111.011 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.8 m -90.99 -55.55 3.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.996 0.427 . . . . 15.26 110.304 179.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.552 HG13 ' HD2' ' A' ' 78' ' ' PHE . 3.7 m -123.56 -21.25 3.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.905 -0.589 . . . . 14.18 111.42 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.43 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 101.73 -17.49 54.71 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.391 -0.909 . . . . 13.85 112.147 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.411 ' H ' HG22 ' A' ' 33' ' ' VAL . 7.3 m-85 -71.41 137.2 48.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.806 0.336 . . . . 18.59 110.554 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 34.1 mm-40 -79.25 152.23 76.08 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.197 -0.668 . . . . 15.890000000000001 109.197 179.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.522 ' HB3' ' HB ' ' A' ' 25' ' ' VAL . 50.8 Cg_exo -53.89 -38.65 86.06 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.454 2.103 . . . . 12.26 112.168 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.433 ' HA ' HD12 ' A' ' 41' ' ' LEU . 26.2 mp0 -68.48 -16.61 63.95 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.833 -0.621 . . . . 13.68 111.624 -179.386 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.17 -23.48 35.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.991 0.424 . . . . 17.34 109.909 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.596 ' HB2' HG22 ' A' ' 25' ' ' VAL . 1.6 mm? -92.67 -32.24 14.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.874 -0.603 . . . . 13.56 110.288 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 86.8 mt -54.92 119.15 4.98 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.091 -0.504 . . . . 13.42 111.496 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.47 4.97 85.35 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.855 -0.688 . . . . 13.390000000000001 112.984 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.626 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 7.7 mmpt? -114.78 157.93 22.57 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 122.556 -0.379 . . . . 17.239999999999998 110.556 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.681 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 16.1 m120 -92.4 134.19 35.17 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.672 -0.492 . . . . 12.77 109.672 179.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.476 HD12 ' HZ ' ' A' ' 61' ' ' PHE . 11.3 tt -56.63 -30.39 31.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.991 0.424 . . . . 12.050000000000001 111.452 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.8 p -70.53 -17.94 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-N 116.247 -0.433 . . . . 13.390000000000001 111.753 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.681 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.2 mt-10 -72.48 -34.21 67.53 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.958 0.408 . . . . 16.530000000000001 110.431 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.442 ' HE1' ' HB3' ' A' ' 43' ' ' LYS . 68.3 m-85 -99.87 21.16 13.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.807 -0.633 . . . . 15.83 110.299 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 13.2 t -108.06 150.49 27.09 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.781 -0.645 . . . . 12.01 110.733 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.525 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 2.1 t-160 -56.09 128.17 71.23 Favored Pre-proline 0 C--N 1.333 -0.139 0 N-CA-C 109.019 -0.734 . . . . 15.130000000000001 109.019 178.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.43 ' HD2' ' CD2' ' A' ' 50' ' ' HIS . 5.7 Cg_endo -50.37 -40.91 52.82 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 122.777 2.318 . . . . 15.83 112.828 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -75.51 -14.55 60.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.484 -0.326 . . . . 16.690000000000001 111.36 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.525 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 34.5 m-20 -103.39 -6.63 21.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.605 -0.27 . . . . 13.16 111.203 -179.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -56.59 -42.56 78.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 16.170000000000002 111.344 -179.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 49.0 tp60 -64.68 -45.28 87.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.43 -0.35 . . . . 14.35 110.425 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.9 tp -59.55 -42.44 92.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.998 -0.546 . . . . 12.51 110.505 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.495 ' HA ' HD21 ' A' ' 57' ' ' LEU . 0.5 OUTLIER -63.16 -54.5 36.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.081 -0.509 . . . . 10.08 110.617 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 56.4 ttt180 -58.53 -41.02 84.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.08 -0.509 . . . . 11.710000000000001 110.919 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.38 -43.33 96.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.958 -0.564 . . . . 9.7100000000000009 110.579 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.6 m -70.19 -32.58 70.57 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.791 -0.64 . . . . 9.5199999999999996 111.148 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.535 ' O ' HG12 ' A' ' 64' ' ' VAL . 8.3 m-85 -62.09 -50.39 72.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.948 0.404 . . . . 12.109999999999999 110.488 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -67.86 -30.77 70.23 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.707 -0.479 . . . . 10.289999999999999 109.707 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -63.17 -45.32 92.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.633 -0.712 . . . . 10.619999999999999 110.915 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.535 HG12 ' O ' ' A' ' 61' ' ' PHE . 1.9 p -67.2 -24.1 31.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-O 120.813 0.34 . . . . 10.93 110.576 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.448 ' O ' ' HG3' ' A' ' 68' ' ' LYS . 69.3 t -72.43 -38.93 61.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 108.963 -0.754 . . . . 12.890000000000001 108.963 178.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 42.1 mtpt -73.46 -30.36 63.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.377 -0.829 . . . . 16.68 109.766 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 22.0 mt -68.36 -57.45 5.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.558 -0.747 . . . . 13.18 110.33 179.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.448 ' HG3' ' O ' ' A' ' 65' ' ' VAL . 67.7 mttt 62.97 83.47 0.16 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.685 -0.689 . . . . 15.17 112.175 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.51 -47.72 1.0 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.579 -0.82 . . . . 10.01 113.127 178.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -71.6 136.22 47.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.944 0.402 . . . . 10.039999999999999 110.599 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.512 ' HB ' ' HZ ' ' B' ' 24' ' ' PHE . 4.1 p -80.44 123.94 37.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.611 -0.722 . . . . 8.5399999999999991 110.229 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 25.2 tp -107.14 109.56 21.42 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.067 0.461 . . . . 8.1300000000000008 110.569 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.436 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 1.3 m -89.56 109.04 20.02 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.796 -0.638 . . . . 7.8899999999999997 110.923 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 p -103.8 129.71 55.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.403 -0.362 . . . . 8.1799999999999997 110.082 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' MET . . . . . 0.415 ' HE1' ' HB3' ' A' ' 87' ' ' TRP . 26.2 ttt -104.28 115.08 29.76 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.096 0.474 . . . . 9.6999999999999993 110.433 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.563 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 31.6 p90 -145.86 178.58 8.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.797 -0.638 . . . . 10.27 109.975 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.77 ' HB3' ' HB3' ' A' ' 85' ' ' TRP . 9.0 mtt180 -98.14 116.51 30.51 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.836 0.35 . . . . 13.859999999999999 110.472 179.256 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.563 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 19.4 t80 -100.95 147.29 26.33 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.107 -0.497 . . . . 9.7300000000000004 109.897 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.427 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 37.9 ttp180 -81.91 132.59 35.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.858 0.361 . . . . 11.300000000000001 111.001 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.451 ' HA ' ' HB ' ' A' ' 33' ' ' VAL . 54.6 p -95.94 -176.69 3.78 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.078 -0.51 . . . . 11.039999999999999 110.108 179.142 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.5 tptt -69.64 -18.74 63.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.344 0.592 . . . . 13.18 109.614 178.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 -91.38 5.33 49.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.634 -0.712 . . . . 14.890000000000001 109.685 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 65.51 23.71 11.83 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.115 -0.948 . . . . 12.92 111.659 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.407 ' HG2' ' OG ' ' A' ' 80' ' ' SER . 2.2 pt-20 -98.71 164.89 12.05 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.123 -0.695 . . . . 10.94 109.123 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.77 ' HB3' ' HB3' ' A' ' 77' ' ' ARG . 55.2 m95 -109.61 112.63 24.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.133 0.492 . . . . 11.77 111.29 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.5 HD22 HG12 ' A' ' 33' ' ' VAL . 1.3 pp -108.66 150.31 27.72 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.77 -0.65 . . . . 11.57 110.17 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.415 ' HB3' ' HE1' ' A' ' 75' ' ' MET . 98.8 m95 -76.34 116.35 16.94 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.019 0.437 . . . . 10.73 110.487 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 18.2 tpp -116.86 129.05 55.83 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.75 -0.659 . . . . 9.7400000000000002 110.718 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.3 ttp180 -100.66 77.4 1.89 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.471 -0.937 . . . . 11.16 108.471 178.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.403 HG22 ' HB3' ' A' ' 108' ' ' CYS . 61.2 m -69.54 108.37 3.78 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.353 -0.84 . . . . 9.5899999999999999 113.033 -177.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.461 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 1.5 m -86.78 95.1 9.72 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.947 -0.76 . . . . 8.8800000000000008 108.947 177.675 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.3 m -83.63 130.71 34.98 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.005 0.372 . . . . 8.9399999999999995 112.005 -178.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -124.58 129.07 49.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.714 -0.675 . . . . 12.1 110.057 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.38 115.23 15.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.29 -0.414 . . . . 10.16 111.001 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -89.99 106.18 18.3 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.968 0.413 . . . . 12.6 110.314 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.571 ' HG2' HG12 ' A' ' 103' ' ' ILE . 16.6 mt-30 -114.8 156.93 23.98 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.776 -0.647 . . . . 14.6 110.689 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.409 ' HB2' ' OE2' ' A' ' 102' ' ' GLU . 92.1 m-20 -95.2 149.09 35.7 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 109.096 -0.705 . . . . 13.83 109.096 178.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -83.15 18.42 1.5 Allowed 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 122.581 2.187 . . . . 15.34 112.58 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -97.71 -66.57 0.89 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.369 -0.378 . . . . 16.890000000000001 110.903 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.4 m -126.01 20.28 7.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.459 -0.337 . . . . 15.140000000000001 110.522 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.7 t70 60.41 33.51 20.7 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.715 -0.675 . . . . 14.94 110.94 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.409 ' OE2' ' HB2' ' A' ' 97' ' ' ASN . 0.5 OUTLIER -78.05 136.9 38.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.936 -0.575 . . . . 12.949999999999999 110.154 -179.826 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.571 HG12 ' HG2' ' A' ' 96' ' ' GLN . 45.8 mt -94.0 114.19 30.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.84 -0.43 . . . . 11.44 109.84 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -77.32 -53.56 7.55 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.828 0.347 . . . . 11.65 110.78 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 15.4 p90 -158.17 -178.27 7.17 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.271 -0.422 . . . . 10.35 110.525 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 24.4 mt -113.34 116.16 51.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.96 -0.564 . . . . 10.470000000000001 110.072 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 59.3 mt -83.21 100.1 6.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.14 -0.482 . . . . 9.3200000000000003 109.875 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.403 ' HB3' HG22 ' A' ' 90' ' ' THR . 51.8 m -94.68 114.71 26.67 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.243 -0.435 . . . . 10.15 111.33 -179.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.461 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 4.0 m -87.51 93.02 9.29 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.912 -0.773 . . . . 11.4 108.912 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.498 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 6.2 m-20 -78.3 99.23 6.22 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.849 -0.614 . . . . 11.640000000000001 112.019 -178.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.771 HG21 HH12 ' B' ' 28' ' ' ARG . 0.7 OUTLIER -107.22 117.74 34.87 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.883 -0.414 . . . . 11.220000000000001 109.883 178.306 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . 0.588 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 8.5 t-20 -76.53 130.13 37.47 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.016 0.436 . . . . 12.98 110.975 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 28.9 t -104.77 -54.79 6.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 115.622 -0.717 . . . . 15.109999999999999 109.576 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 46.7 mtpt . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.141 -0.933 . . . . 16.32 110.006 -179.656 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 77.2 m . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 110.173 -0.306 . . . . 7.8399999999999999 110.173 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -120.72 151.5 54.51 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 116.565 -0.289 . . . . 7.4900000000000002 110.224 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -66.06 161.13 41.24 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.751 2.3 . . . . 6.4400000000000004 112.664 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' THR . . . . . 0.458 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.3 OUTLIER -82.09 59.81 4.59 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.834 -0.621 . . . . 5.9800000000000004 111.364 -179.499 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.527 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -156.38 153.28 28.69 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.811 -0.811 . . . . 5.8499999999999996 108.811 179.184 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -158.83 158.54 33.68 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.137 0.494 . . . . 6.4900000000000002 111.358 179.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . 0.544 ' HB ' ' HB2' ' B' ' 26' ' ' ASP . 21.5 mm -93.35 117.05 35.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.541 -0.754 . . . . 6.0199999999999996 110.09 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.655 ' HB3' ' HE2' ' B' ' 22' ' ' PHE . 0.6 OUTLIER -107.32 96.31 6.32 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.094 -0.503 . . . . 5.3700000000000001 111.303 -179.084 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . 0.652 ' HD3' ' HB3' ' B' ' 24' ' ' PHE . 23.5 mtp85 -90.66 107.7 19.34 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.908 -0.775 . . . . 9.4600000000000009 108.908 179.046 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . 0.439 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 31.3 p80 -136.98 165.55 25.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.63 -0.259 . . . . 8.3100000000000005 111.45 -178.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -77.94 177.33 8.34 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 116.038 -0.528 . . . . 11.19 110.245 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 22.8 pt -58.11 -30.48 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 N-CA-C 112.917 0.71 . . . . 9.3699999999999992 112.917 -178.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -78.63 -16.85 56.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.08 0.467 . . . . 11.92 111.495 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 108.16 -1.12 33.25 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.432 -0.89 . . . . 8.6799999999999997 112.359 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . 0.504 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 33.1 mm -69.56 111.87 3.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 N-CA-C 109.805 -0.443 . . . . 11.16 109.805 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . 0.655 ' HE2' ' HB3' ' B' ' 14' ' ' SER . 57.1 m-85 -63.57 126.72 28.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.248 -0.433 . . . . 8.5999999999999996 110.972 -179.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 1.4 m -100.64 -33.37 10.32 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.957 -0.565 . . . . 7.9100000000000001 110.237 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . 0.652 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 32.3 t80 -156.62 127.33 6.72 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.693 -0.685 . . . . 8.5 109.437 179.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 15.0 t -115.02 138.3 45.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.434 -0.348 . . . . 6.5 110.672 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . 0.544 ' HB2' ' HB ' ' B' ' 13' ' ' ILE . 9.6 t70 -75.02 141.65 43.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.058 -0.519 . . . . 7.1500000000000004 109.698 179.173 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 18.4 m170 -70.4 87.54 0.63 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.05 0.453 . . . . 9.4100000000000001 110.185 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . 0.771 HH12 HG21 ' A' ' 111' ' ' THR . 12.5 mtm180 -169.53 -21.57 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.022 -0.99 . . . . 9.7599999999999998 110.408 -179.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 24.3 p -55.86 -30.53 61.65 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.601 0.593 . . . . 11.56 112.601 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 t -68.36 -21.84 26.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.138 0.494 . . . . 14.01 110.782 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -96.25 -19.49 19.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.151 -0.477 . . . . 12.9 110.039 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 2.5 m -85.61 -60.02 2.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.978 -0.555 . . . . 12.34 111.303 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' VAL . . . . . 0.522 HG13 ' HD2' ' B' ' 78' ' ' PHE . 3.5 m -116.58 -14.52 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.808 0.337 . . . . 13.869999999999999 111.586 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.82 -2.96 77.27 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.503 -0.856 . . . . 14.369999999999999 112.817 179.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 5.4 m-85 -82.32 137.8 34.7 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.716 0.293 . . . . 15.56 110.62 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . 0.81 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 77.5 mm-40 -73.21 146.75 87.27 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 116.092 -0.504 . . . . 13.859999999999999 109.769 179.114 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.555 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 51.1 Cg_exo -53.89 -39.76 83.28 Favored 'Trans proline' 0 CA--C 1.529 0.27 0 C-N-CA 122.38 2.053 . . . . 15.210000000000001 112.125 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -69.34 -14.52 62.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.849 -0.614 . . . . 17.82 111.864 -179.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.81 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 29.3 mt-10 -82.72 -21.07 34.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.94 0.4 . . . . 14.42 110.368 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.447 ' HB3' ' CG ' ' B' ' 22' ' ' PHE . 1.2 mm? -94.57 -28.5 15.37 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.802 -0.635 . . . . 14.550000000000001 110.016 179.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 87.1 mt -62.71 119.21 8.84 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.986 -0.552 . . . . 14.050000000000001 110.692 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 90.24 -2.98 81.97 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.911 -0.661 . . . . 11.68 112.097 -179.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.504 ' O ' ' HA ' ' B' ' 21' ' ' ILE . 1.5 mmpt? -109.14 161.66 15.0 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.681 0.277 . . . . 14.17 110.29 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' ASN . . . . . 0.767 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 15.4 m120 -96.63 135.24 38.81 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.484 -0.562 . . . . 10.74 109.484 179.626 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.1 tt -60.68 -22.65 26.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.224 0.535 . . . . 9.8800000000000008 110.75 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 9.9 p -74.59 -18.19 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 116.052 -0.522 . . . . 11.779999999999999 111.196 -179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . 0.767 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 36.5 mt-10 -73.85 -38.25 64.55 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.959 0.409 . . . . 11.890000000000001 110.877 -179.526 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' PHE . . . . . 0.489 ' HB2' ' CZ ' ' B' ' 78' ' ' PHE . 25.4 m-85 -96.34 18.28 14.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.018 -0.537 . . . . 14.279999999999999 110.575 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 51.9 t -103.11 149.56 24.49 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.071 -0.513 . . . . 10.81 110.647 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' HIS . . . . . 0.656 ' HB3' ' HB2' ' B' ' 53' ' ' ASP . 9.3 t-160 -57.19 127.63 76.7 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.663 -0.699 . . . . 12.029999999999999 109.17 178.46 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_exo -45.06 -50.8 8.37 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.083 2.522 . . . . 11.869999999999999 113.438 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 13.5 mp0 -75.08 4.15 7.26 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.447 0.536 . . . . 9.2799999999999994 112.447 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . 0.656 ' HB2' ' HB3' ' B' ' 50' ' ' HIS . 6.0 m-20 -122.46 -0.22 9.3 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.108 0.48 . . . . 7.5199999999999996 110.341 179.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -66.69 -38.37 86.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.802 -0.635 . . . . 6.5700000000000003 110.794 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 48.1 tp60 -65.65 -45.21 83.84 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.682 -0.488 . . . . 6.9900000000000002 109.682 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 40.7 tp -58.77 -42.49 89.07 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.482 -0.781 . . . . 5.1399999999999997 110.573 179.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . 0.41 ' HA ' HD21 ' B' ' 57' ' ' LEU . 1.1 mt -63.02 -54.55 36.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.032 -0.531 . . . . 6.8200000000000003 110.777 179.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 42.2 ttt180 -58.36 -43.63 88.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 8.6899999999999995 111.059 -179.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -60.14 -46.04 91.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.042 -0.526 . . . . 6.46 110.645 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 42.5 m -63.92 -39.02 93.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.069 -0.514 . . . . 5.5899999999999999 110.726 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' PHE . . . . . 0.451 ' O ' HG12 ' B' ' 64' ' ' VAL . 9.7 m-85 -62.95 -44.13 96.91 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.829 0.347 . . . . 8.3300000000000001 110.287 179.392 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -66.93 -35.0 79.0 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.309 -0.405 . . . . 7.1500000000000004 110.375 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.402 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 27.2 mt-30 -69.92 -40.76 75.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.109 -0.496 . . . . 9.5299999999999994 111.593 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.451 HG12 ' O ' ' B' ' 61' ' ' PHE . 9.8 p -70.02 -25.96 28.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 120.917 0.389 . . . . 8.2200000000000006 110.832 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . 0.597 ' HA ' HG21 ' B' ' 94' ' ' THR . 24.6 t -68.44 -32.81 56.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.389 0.614 . . . . 7.4299999999999997 109.407 178.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -78.53 -11.49 59.96 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.475 -0.784 . . . . 10.52 110.85 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.596 ' HB3' ' HB2' ' B' ' 70' ' ' GLN . 96.8 mt -82.7 -55.7 4.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.128 -0.487 . . . . 7.5300000000000002 109.996 179.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 79.8 mttt 66.18 111.22 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.492 -0.777 . . . . 8.0099999999999998 111.702 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . 0.419 ' HA3' ' OE1' ' B' ' 96' ' ' GLN . . . 75.98 19.54 78.63 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.626 -0.797 . . . . 5.8700000000000001 112.291 179.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . 0.596 ' HB2' ' HB3' ' B' ' 67' ' ' LEU . 26.6 mm-40 -128.45 163.66 24.42 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.665 -0.495 . . . . 5.6299999999999999 109.665 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' VAL . . . . . 0.431 ' HB ' ' HD1' ' B' ' 93' ' ' PHE . 9.8 p -116.72 131.16 70.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 121.27 0.557 . . . . 6.0599999999999996 111.068 -179.232 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 21.0 tp -118.46 116.02 25.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.932 -0.577 . . . . 4.9299999999999997 109.616 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' SER . . . . . 0.421 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.8 m -92.31 114.77 27.41 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.836 -0.62 . . . . 6.79 111.351 -179.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . 0.436 HG12 ' HB ' ' B' ' 90' ' ' THR . 2.5 p -108.04 128.8 63.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.931 -0.577 . . . . 4.4199999999999999 110.0 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 27.9 ttt -102.16 108.08 19.37 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.032 0.444 . . . . 5.6699999999999999 110.525 -179.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.425 ' HE2' ' HD1' ' B' ' 78' ' ' PHE . 26.8 p90 -138.49 -171.45 3.06 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.895 -0.593 . . . . 3.75 109.893 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' ARG . . . . . 0.579 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 59.0 mtm180 -114.66 119.29 36.23 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.15 0.5 . . . . 7.3499999999999996 110.53 179.27 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . 0.522 ' HD2' HG13 ' B' ' 33' ' ' VAL . 19.7 t80 -99.53 144.85 28.15 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.451 -0.795 . . . . 5.79 110.504 -179.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' ARG . . . . . . . . . . . . . 39.7 ttp180 -82.62 120.02 25.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.365 -0.38 . . . . 11.529999999999999 110.208 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' SER . . . . . 0.466 ' OG ' ' HG2' ' B' ' 84' ' ' GLU . 99.8 p -87.71 -175.21 5.09 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.841 0.353 . . . . 7.4699999999999998 110.747 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 39.8 tptt -66.37 -16.72 64.29 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.023 -0.535 . . . . 12.67 110.418 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 23.7 m-20 -92.84 4.18 54.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.02 -0.536 . . . . 9.25 109.837 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 68.86 16.36 8.85 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.323 -0.853 . . . . 8.75 112.029 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . 0.466 ' HG2' ' OG ' ' B' ' 80' ' ' SER . 13.4 pt-20 -97.01 148.08 23.35 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.683 -0.488 . . . . 6.8700000000000001 109.683 179.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . 0.579 ' HB3' ' HB3' ' B' ' 77' ' ' ARG . 2.7 m95 -95.05 103.63 15.49 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.089 -0.337 . . . . 8.3800000000000008 110.089 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . 0.495 HD21 HG12 ' B' ' 33' ' ' VAL . 1.6 pp -97.45 146.43 25.22 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.515 -0.311 . . . . 7.25 110.645 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 87' ' ' TRP . . . . . 0.586 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 87.0 m95 -72.8 116.97 13.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.392 -0.367 . . . . 9.3000000000000007 110.111 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 88' ' ' MET . . . . . 0.413 ' SD ' ' HB3' ' B' ' 110' ' ' ASN . 3.9 ttp -131.3 134.57 46.49 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.01 -0.541 . . . . 4.46 110.657 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 37.5 ttp180 -96.98 105.28 17.4 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.72 -0.673 . . . . 7.3099999999999996 109.353 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 90' ' ' THR . . . . . 0.777 HG22 ' HB3' ' B' ' 108' ' ' CYS . 19.7 m -88.32 106.89 18.53 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.895 -0.593 . . . . 6.1799999999999997 111.014 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 91' ' ' SER . . . . . 0.469 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 0.8 OUTLIER -87.9 88.58 7.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.827 -0.624 . . . . 6.4500000000000002 109.321 179.129 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 9.3 m -80.49 122.65 27.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.082 -0.508 . . . . 6.75 111.968 -178.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . 0.431 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 77.6 t80 -115.47 125.46 53.11 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.261 -0.427 . . . . 6.4500000000000002 109.949 178.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 94' ' ' THR . . . . . 0.597 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.4 OUTLIER -88.33 104.3 16.63 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.757 0.313 . . . . 9.8800000000000008 110.735 179.763 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -71.7 132.45 44.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.307 -0.406 . . . . 8.9100000000000001 110.541 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 96' ' ' GLN . . . . . 0.419 ' OE1' ' HA3' ' B' ' 69' ' ' GLY . 50.9 mt-30 -99.0 137.65 37.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.851 -0.613 . . . . 10.99 111.851 -178.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 97' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -89.85 124.13 64.51 Favored Pre-proline 0 C--N 1.323 -0.568 0 N-CA-C 108.329 -0.989 . . . . 8.5099999999999998 108.329 177.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.54 51.19 1.11 Allowed 'Trans proline' 0 CA--C 1.534 0.479 0 C-N-CA 123.137 2.558 . . . . 9.1600000000000001 113.703 -179.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -138.02 -77.82 0.37 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.547 -0.297 . . . . 11.390000000000001 110.425 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 14.7 m -113.24 20.11 16.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.128 0.49 . . . . 7.9000000000000004 109.908 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.6 t0 61.66 35.03 17.27 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.087 -0.961 . . . . 9.0800000000000001 111.341 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -82.07 164.93 21.04 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.967 -0.561 . . . . 7.71 109.767 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 69.4 mt -103.33 118.77 50.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.486 -0.324 . . . . 8.3800000000000008 110.284 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -66.09 -64.26 0.9 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.063 0.458 . . . . 8.8100000000000005 109.788 179.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 6.6 p90 -157.92 172.47 18.4 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.392 -0.822 . . . . 7.8200000000000003 109.666 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 57.8 mt -102.96 113.16 38.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.403 -0.362 . . . . 7.2199999999999998 110.081 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 13.2 mt -88.91 105.52 15.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 109.332 -0.618 . . . . 6.7199999999999998 109.332 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' CYS . . . . . 0.777 ' HB3' HG22 ' B' ' 90' ' ' THR . 97.1 m -99.25 106.1 18.19 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.375 0.509 . . . . 5.3099999999999996 112.375 -178.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' THR . . . . . 0.469 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 2.9 m -79.89 84.26 5.69 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.647 -0.872 . . . . 5.8700000000000001 108.647 177.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' ASN . . . . . 0.413 ' HB3' ' SD ' ' B' ' 88' ' ' MET . 7.3 m-20 -71.16 121.71 18.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.552 -0.749 . . . . 6.9000000000000004 111.752 -178.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.13 116.63 22.36 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.213 -0.448 . . . . 8.9000000000000004 110.111 179.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 112' ' ' ASN . . . . . 0.458 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 8.1 t-20 -68.44 135.3 51.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.116 0.484 . . . . 11.84 110.875 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 2.0 t -109.12 -50.12 7.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.683 -0.69 . . . . 12.4 109.9 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . 0.586 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 92.0 mttt . . . . . 0 C--O 1.246 0.905 0 CA-C-O 118.61 -0.71 . . . . 12.68 109.829 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.2 m . . . . . 0 N--CA 1.476 0.871 0 N-CA-C 110.45 -0.204 . . . . 15.82 110.45 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -87.52 111.52 42.21 Favored Pre-proline 0 C--N 1.326 -0.456 0 N-CA-C 109.794 -0.447 . . . . 15.44 109.794 178.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -69.57 159.9 51.79 Favored 'Trans proline' 0 C--O 1.233 0.271 0 C-N-CA 122.805 2.337 . . . . 14.109999999999999 112.664 -179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.491 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.0 OUTLIER -86.87 55.77 3.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.853 -0.612 . . . . 11.369999999999999 110.233 179.79 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.456 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 8.8 tt0 -157.55 144.06 17.9 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.492 -0.776 . . . . 10.59 109.728 -178.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.792 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 27.2 p90 -150.63 143.58 24.69 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.066 0.46 . . . . 9.1999999999999993 111.114 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.455 HG21 HG21 ' A' ' 107' ' ' ILE . 50.5 mm -80.0 115.23 22.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.902 -0.59 . . . . 8.9399999999999995 110.444 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.906 ' HB3' ' HE2' ' A' ' 22' ' ' PHE . 1.6 m -100.21 99.52 10.22 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.986 -0.552 . . . . 6.1100000000000003 110.94 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.648 ' HD3' ' HB3' ' A' ' 24' ' ' PHE . 15.1 mtp180 -91.72 106.7 18.67 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.419 -0.586 . . . . 9.4600000000000009 109.419 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.8 p80 -133.73 159.98 38.94 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.507 -0.315 . . . . 10.369999999999999 110.887 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -75.82 179.32 5.55 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.336 -0.393 . . . . 13.279999999999999 110.618 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.1 pt -53.93 -36.45 30.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 112.528 0.566 . . . . 13.970000000000001 112.528 -179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -68.82 -46.47 68.54 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.989 0.424 . . . . 13.85 111.039 -179.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 137.22 -8.46 3.79 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.609 -0.805 . . . . 9.6099999999999994 111.724 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.459 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 33.5 mm -64.99 116.1 3.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 109.908 -0.405 . . . . 11.289999999999999 109.908 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.906 ' HE2' ' HB3' ' A' ' 14' ' ' SER . 89.7 m-85 -66.82 122.33 17.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.156 -0.474 . . . . 10.449999999999999 110.885 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.82 -32.59 13.89 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.678 -0.692 . . . . 8.1300000000000008 109.735 179.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.648 ' HB3' ' HD3' ' A' ' 15' ' ' ARG . 55.1 t80 -147.43 133.63 19.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.517 -0.765 . . . . 7.4900000000000002 109.337 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.405 HG21 ' HB2' ' A' ' 40' ' ' LEU . 22.1 t -119.41 147.19 23.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.253 0.549 . . . . 6.4500000000000002 111.606 -178.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.792 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 5.4 t70 -68.8 -179.55 1.47 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 114.911 -1.04 . . . . 7.3099999999999996 110.499 179.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 25.8 m170 -108.34 -20.29 13.18 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.105 0.479 . . . . 12.41 110.226 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 63.9 mtm180 -76.94 -6.68 53.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.83 -0.623 . . . . 12.19 111.272 -179.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 25.1 p -57.65 -31.23 66.09 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.344 -0.389 . . . . 13.5 111.376 -179.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.487 ' O ' ' HA2' ' A' ' 34' ' ' GLY . 13.4 t -62.84 -31.43 52.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.943 -0.571 . . . . 16.559999999999999 111.057 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -92.77 -17.54 24.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.966 0.412 . . . . 15.07 110.781 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.485 ' HA ' HG21 ' A' ' 10' ' ' THR . 5.3 m -82.11 -67.33 0.79 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.067 -0.515 . . . . 15.26 110.927 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 2.4 m -113.11 -8.79 12.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.381 -0.372 . . . . 14.18 111.51 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.487 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 85.56 -2.64 87.9 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.519 -0.848 . . . . 13.85 112.234 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -78.16 136.7 37.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.858 0.361 . . . . 18.59 110.771 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.552 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 26.0 mm-40 -77.98 149.31 76.65 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 108.708 -0.849 . . . . 15.890000000000001 108.708 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.42 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 76.4 Cg_exo -51.3 -38.19 61.63 Favored 'Trans proline' 0 CA--C 1.53 0.287 0 C-N-CA 122.555 2.17 . . . . 12.26 112.853 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.518 ' HA ' HD12 ' A' ' 41' ' ' LEU . 19.9 mp0 -71.67 -14.84 62.16 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.155 -0.475 . . . . 13.68 111.729 -179.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.552 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 31.5 mt-10 -81.18 -22.8 38.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.788 0.328 . . . . 17.34 110.295 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.405 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.9 mm? -94.68 -34.68 12.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.978 -0.555 . . . . 13.56 109.989 179.519 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 38' ' ' GLN . 82.5 mt -57.88 120.89 9.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.808 -0.633 . . . . 13.42 111.068 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.15 3.3 87.52 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.66 -0.781 . . . . 13.390000000000001 112.471 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.742 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 8.7 mmpt? -112.64 163.25 14.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.86 0.362 . . . . 17.239999999999998 110.3 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.657 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 7.8 m120 -96.41 137.53 35.34 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.997 -0.547 . . . . 12.77 110.008 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 19.7 tt -63.47 -23.37 33.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.113 0.482 . . . . 12.050000000000001 111.075 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.423 HG13 ' HB3' ' A' ' 44' ' ' ASN . 8.3 p -78.73 -16.49 13.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.275 -0.42 . . . . 13.390000000000001 111.445 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.657 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.2 mt-10 -69.36 -39.83 77.86 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.019 0.437 . . . . 16.530000000000001 110.817 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.4 ' HB2' ' CZ ' ' A' ' 78' ' ' PHE . 22.8 m-85 -97.91 23.89 7.54 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.015 -0.539 . . . . 15.83 110.402 -179.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.527 ' HG ' HD13 ' A' ' 57' ' ' LEU . 52.4 t -104.94 147.18 28.06 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 115.847 -0.615 . . . . 12.01 110.066 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.446 ' CD2' ' HD2' ' A' ' 51' ' ' PRO . 8.4 t-160 -58.98 127.38 83.48 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.128 -0.487 . . . . 15.130000000000001 109.734 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.446 ' HD2' ' CD2' ' A' ' 50' ' ' HIS . 88.9 Cg_exo -43.6 -50.73 6.74 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.308 2.672 . . . . 15.83 113.77 -179.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.49 -3.27 17.02 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.48 0.548 . . . . 16.690000000000001 112.48 -179.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -120.58 1.83 10.64 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 122.195 -0.315 . . . . 13.16 110.901 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -62.85 -47.45 83.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.175 -0.466 . . . . 16.170000000000002 111.406 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 44.8 tp60 -69.38 -34.71 74.94 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.57 -0.53 . . . . 14.35 109.57 178.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.7 tp -57.76 -40.87 80.78 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.34 0.59 . . . . 12.51 109.81 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.527 HD13 ' HG ' ' A' ' 49' ' ' CYS . 0.7 OUTLIER -66.81 -46.06 76.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.468 -0.787 . . . . 10.08 110.02 179.052 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 69.1 ttt180 -61.45 -43.67 98.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.143 -0.481 . . . . 11.710000000000001 110.775 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -58.91 -39.13 80.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.214 0.53 . . . . 9.7100000000000009 110.288 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.3 m -72.36 -33.9 67.61 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.679 -0.691 . . . . 9.5199999999999996 110.618 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.492 ' O ' HG13 ' A' ' 64' ' ' VAL . 4.6 m-85 -64.29 -45.99 85.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.887 0.375 . . . . 12.109999999999999 110.207 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -64.15 -33.06 74.92 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.991 0.424 . . . . 10.289999999999999 109.928 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -64.77 -48.87 72.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.777 -0.647 . . . . 10.619999999999999 110.724 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.584 ' HA ' HD12 ' A' ' 67' ' ' LEU . 4.2 p -65.17 -26.93 40.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 CA-C-N 116.646 -0.252 . . . . 10.93 111.268 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 61' ' ' PHE . 55.5 t -69.31 -37.28 75.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 121.299 0.571 . . . . 12.890000000000001 109.694 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 27.4 mtpt -78.99 -33.0 45.42 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.794 -0.639 . . . . 16.68 109.946 179.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.701 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 66.6 mt -60.0 -56.56 20.14 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.914 -0.584 . . . . 13.18 110.639 179.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 65.3 mttt 62.21 103.65 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 O-C-N 123.861 0.726 . . . . 15.17 112.163 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 83.69 19.81 61.03 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.369 -0.919 . . . . 10.01 112.132 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.701 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 7.9 tp-100 -128.84 139.35 52.21 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.167 -0.679 . . . . 10.039999999999999 109.167 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.481 ' CG2' ' HB3' ' A' ' 91' ' ' SER . 2.6 p -97.25 117.4 41.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.129 0.49 . . . . 8.5399999999999991 110.383 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 46.4 tp -106.33 117.08 33.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.907 -0.588 . . . . 8.1300000000000008 110.488 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.525 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 9.1 m -93.79 106.93 18.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.054 -0.521 . . . . 7.8899999999999997 110.97 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.2 p -99.67 132.02 45.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.186 -0.461 . . . . 8.1799999999999997 110.19 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 23.6 ttt -102.86 119.45 38.86 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.344 -0.389 . . . . 9.6999999999999993 110.344 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.504 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 46.8 p90 -150.32 -174.67 4.81 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.787 -0.642 . . . . 10.27 109.385 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.454 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 36.1 mtm180 -107.38 121.79 45.29 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.153 0.501 . . . . 13.859999999999999 110.954 179.412 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.504 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 13.0 t80 -104.12 148.46 26.24 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.352 -0.84 . . . . 9.7300000000000004 109.728 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.607 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 1.1 ttt180 -88.09 123.67 33.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.9 0.381 . . . . 11.300000000000001 110.735 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.555 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 85.2 p -85.38 -176.5 6.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.018 -0.537 . . . . 11.039999999999999 109.908 179.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.419 ' HD2' ' HA ' ' A' ' 81' ' ' LYS . 35.4 tptt -67.97 -17.3 64.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.321 0.581 . . . . 13.18 109.755 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -88.34 2.92 51.51 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.581 -0.736 . . . . 14.890000000000001 110.247 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 67.23 19.32 10.3 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 115.596 -0.729 . . . . 12.92 110.842 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.555 ' HG2' ' OG ' ' A' ' 80' ' ' SER . 5.8 pt-20 -94.59 154.37 17.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.087 -0.506 . . . . 10.94 109.902 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.607 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 44.7 m95 -101.36 105.77 16.86 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.422 -0.354 . . . . 11.77 110.61 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.454 ' O ' ' HA ' ' A' ' 77' ' ' ARG . 1.5 pp -107.92 151.63 25.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.23 -0.441 . . . . 11.57 110.385 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.578 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 89.8 m95 -78.43 120.88 23.79 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.073 0.463 . . . . 10.73 110.7 -179.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 5.9 tpp -122.96 140.2 53.27 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.748 -0.66 . . . . 9.7400000000000002 111.071 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.437 ' CZ ' ' HG ' ' A' ' 91' ' ' SER . 1.6 ttp180 -102.44 94.37 5.65 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.343 -0.984 . . . . 11.16 108.343 177.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.571 HG22 ' HB3' ' A' ' 108' ' ' CYS . 45.4 m -86.92 105.21 16.93 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.893 -0.594 . . . . 9.5899999999999999 112.048 -178.591 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.814 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 70.8 m -88.29 92.34 9.13 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.981 -0.554 . . . . 8.8800000000000008 109.629 178.341 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.5 m -81.08 124.03 28.87 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.809 -0.632 . . . . 8.9399999999999995 111.03 -178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -121.57 120.16 34.02 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.815 -0.63 . . . . 12.1 109.488 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.09 115.11 10.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.875 0.369 . . . . 10.16 111.199 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -92.34 109.47 20.85 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.236 -0.438 . . . . 12.6 109.97 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -104.68 152.09 22.92 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.818 -0.628 . . . . 14.6 111.316 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -91.75 137.95 25.26 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.67 -0.695 . . . . 13.83 109.425 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -73.6 36.59 0.39 Allowed 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 122.695 2.263 . . . . 15.34 113.451 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -109.77 -68.61 0.91 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.786 0.327 . . . . 16.890000000000001 110.545 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.64 20.68 8.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.335 -0.393 . . . . 15.140000000000001 110.806 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 24.2 t70 67.8 23.61 8.46 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.55 0.691 . . . . 14.94 110.406 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -82.87 142.98 31.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.055 -0.52 . . . . 12.949999999999999 111.217 -178.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 43.9 mt -87.27 113.5 24.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.191 -0.458 . . . . 11.44 110.274 179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -77.46 -41.76 38.45 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 121.069 -0.252 . . . . 11.65 110.415 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 29.4 p90 -163.82 175.15 10.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.697 0.285 . . . . 10.35 110.353 178.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 60.2 mt -118.4 121.88 68.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 116.283 -0.417 . . . . 10.470000000000001 110.449 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.473 HG12 ' HG2' ' A' ' 15' ' ' ARG . 42.1 mt -90.26 107.65 18.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.704 -0.48 . . . . 9.3200000000000003 109.704 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.571 ' HB3' HG22 ' A' ' 90' ' ' THR . 72.8 m -98.96 112.7 24.74 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.186 0.517 . . . . 10.15 111.017 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.814 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 7.7 m -83.02 90.87 7.07 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.769 -0.826 . . . . 11.4 108.769 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.456 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 6.3 m-20 -79.29 94.63 5.5 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.825 -0.625 . . . . 11.640000000000001 111.67 -178.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 6.5 m -104.05 113.77 27.54 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.835 -0.431 . . . . 11.220000000000001 109.835 178.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . 0.491 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 9.4 t-20 -68.46 135.19 51.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.151 0.501 . . . . 12.98 111.097 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.402 HG11 ' HG3' ' A' ' 114' ' ' LYS . 40.7 t -109.3 -51.62 6.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.667 -0.697 . . . . 15.109999999999999 109.999 179.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.578 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 44.4 mtpt . . . . . 0 C--O 1.253 1.262 0 CA-C-O 118.276 -0.868 . . . . 16.32 109.917 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 22.0 m . . . . . 0 N--CA 1.478 0.946 0 CA-C-O 120.857 0.361 . . . . 7.8399999999999999 110.074 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -138.65 163.54 46.13 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.349 -0.387 . . . . 7.4900000000000002 110.77 -178.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.48 167.59 23.62 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.895 2.396 . . . . 6.4400000000000004 112.023 179.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' THR . . . . . 0.599 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.0 OUTLIER -83.17 58.49 4.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.235 0.54 . . . . 5.9800000000000004 111.145 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.652 ' HA ' ' O ' ' B' ' 110' ' ' ASN . 22.6 tt0 -162.09 129.05 3.79 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.496 -0.775 . . . . 5.8499999999999996 109.443 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -138.55 154.69 48.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.199 0.523 . . . . 6.4900000000000002 111.661 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . 0.631 ' HB ' ' HB2' ' B' ' 26' ' ' ASP . 10.5 mm -88.35 120.43 37.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.54 -0.755 . . . . 6.0199999999999996 110.664 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.696 ' HB3' ' HE2' ' B' ' 22' ' ' PHE . 0.7 OUTLIER -108.58 93.71 4.67 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.776 -0.647 . . . . 5.3700000000000001 110.374 179.723 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . 0.605 ' HD3' ' HB3' ' B' ' 24' ' ' PHE . 11.2 mtp85 -85.72 108.65 18.15 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.375 -0.602 . . . . 9.4600000000000009 109.375 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . 0.456 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 30.3 p80 -141.44 166.03 25.88 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.44 -0.345 . . . . 8.3100000000000005 111.14 -179.152 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 12.0 p-10 -79.36 -177.76 5.9 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.235 -0.439 . . . . 11.19 110.469 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . 0.449 HG13 ' N ' ' B' ' 19' ' ' GLU . 9.8 pt -59.1 -35.02 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 112.459 0.54 . . . . 9.3699999999999992 112.459 -178.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . 0.449 ' N ' HG13 ' B' ' 18' ' ' ILE . 18.2 mt-10 -71.87 -28.3 63.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.018 0.437 . . . . 11.92 111.29 -179.371 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 117.44 -1.91 18.43 Favored Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 120.428 -0.892 . . . . 8.6799999999999997 113.168 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . 0.453 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 36.9 mm -66.29 111.17 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.03 -0.359 . . . . 11.16 110.03 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . 0.696 ' HE2' ' HB3' ' B' ' 14' ' ' SER . 95.5 m-85 -66.85 130.92 44.72 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.175 -0.466 . . . . 8.5999999999999996 110.941 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 1.1 m -108.6 -27.55 9.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.923 -0.581 . . . . 7.9100000000000001 110.64 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . 0.605 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 15.7 t80 -160.21 137.19 9.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.014 -0.539 . . . . 8.5 109.97 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 10.9 t -125.69 146.06 32.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.429 -0.35 . . . . 6.5 110.811 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . 0.631 ' HB2' ' HB ' ' B' ' 13' ' ' ILE . 5.8 t0 -71.16 161.89 30.35 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.463 -0.569 . . . . 7.1500000000000004 109.463 179.036 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 17.1 m170 -80.26 37.03 0.37 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.811 0.339 . . . . 9.4100000000000001 111.251 -179.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . 0.511 ' HD2' ' O ' ' B' ' 11' ' ' GLU . 29.0 mtm180 -128.39 3.07 5.66 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.887 0.375 . . . . 9.7599999999999998 111.114 -179.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 1.8 p -62.74 -46.77 86.51 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 112.413 0.523 . . . . 11.56 112.413 -178.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 6.7 t -67.54 -26.48 35.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 121.079 0.466 . . . . 14.01 111.038 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.87 -22.13 43.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.217 -0.447 . . . . 12.9 111.108 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 13.0 m -92.57 -59.7 2.01 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.29 0.478 . . . . 12.34 112.29 -178.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' VAL . . . . . 0.559 HG11 HD21 ' B' ' 86' ' ' LEU . 3.2 m -118.63 -5.53 11.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 112.195 0.442 . . . . 13.869999999999999 112.195 -178.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.3 20.34 64.76 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.536 -0.84 . . . . 14.369999999999999 112.21 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' TYR . . . . . 0.456 ' HD1' ' HA ' ' B' ' 35' ' ' TYR . 1.0 OUTLIER -93.0 130.72 38.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.675 0.274 . . . . 15.56 110.909 -179.726 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -75.0 144.86 80.13 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 109.111 -0.7 . . . . 13.859999999999999 109.111 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.429 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 52.2 Cg_exo -54.52 -32.99 76.42 Favored 'Trans proline' 0 CA--C 1.529 0.233 0 C-N-CA 122.459 2.106 . . . . 15.210000000000001 112.23 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' GLN . . . . . 0.563 ' HA ' HD12 ' B' ' 41' ' ' LEU . 26.9 mp0 -75.52 -17.11 60.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.615 -0.721 . . . . 17.82 111.971 -179.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -75.54 -40.26 57.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.96 0.409 . . . . 14.42 110.574 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.513 ' HB3' ' CG ' ' B' ' 22' ' ' PHE . 1.9 mm? -74.84 -26.02 59.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.836 -0.62 . . . . 14.550000000000001 111.201 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . 0.563 HD12 ' HA ' ' B' ' 38' ' ' GLN . 75.3 mt -61.48 119.8 9.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 14.050000000000001 111.469 -179.095 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.6 11.72 79.32 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.834 -0.698 . . . . 11.68 113.055 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.567 ' HA ' ' HE2' ' B' ' 43' ' ' LYS . 8.6 mmpt? -121.88 158.58 28.67 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.754 0.311 . . . . 14.17 110.479 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' ASN . . . . . 0.532 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 12.4 m120 -94.16 139.94 30.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.055 -0.52 . . . . 10.74 109.84 179.44 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.6 tt -62.08 -24.48 34.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.996 0.427 . . . . 9.8800000000000008 111.378 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 6.3 p -71.88 -18.29 19.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.172 -0.467 . . . . 11.779999999999999 111.217 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . 0.532 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 38.1 mt-10 -75.81 -23.15 55.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.995 0.426 . . . . 11.890000000000001 111.031 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -110.09 22.05 16.05 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.023 -0.535 . . . . 14.279999999999999 110.092 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 51.4 t -110.6 150.87 28.34 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.682 -0.69 . . . . 10.81 110.451 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -59.64 126.24 82.19 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.807 -0.633 . . . . 12.029999999999999 109.576 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_exo -47.29 -42.21 27.55 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.058 2.505 . . . . 11.869999999999999 113.58 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 9.1 mp0 -78.45 0.32 26.31 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 112.334 0.494 . . . . 9.2799999999999994 112.334 -179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -129.83 5.05 5.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.888 0.375 . . . . 7.5199999999999996 110.933 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -63.75 -43.46 96.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.104 -0.498 . . . . 6.5700000000000003 110.719 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 49.6 tp60 -63.63 -39.63 94.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.956 -0.566 . . . . 6.9900000000000002 109.535 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.78 -42.42 84.08 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.986 -0.552 . . . . 5.1399999999999997 110.498 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . 0.463 HD21 ' HA ' ' B' ' 57' ' ' LEU . 0.5 OUTLIER -63.72 -51.76 63.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 6.8200000000000003 110.269 179.489 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -58.79 -44.29 90.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.82 -0.627 . . . . 8.6899999999999995 110.878 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -59.25 -42.87 92.13 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.749 -0.66 . . . . 6.46 110.975 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 20.3 m -66.82 -34.02 76.9 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.867 -0.606 . . . . 5.5899999999999999 110.592 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' PHE . . . . . 0.418 ' O ' HG23 ' B' ' 65' ' ' VAL . 9.5 m-85 -64.64 -37.87 89.05 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.104 0.478 . . . . 8.3300000000000001 109.781 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 21.1 mm100 -63.99 -44.45 92.62 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.805 -0.634 . . . . 7.1500000000000004 110.524 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -68.08 -40.44 82.68 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.615 -0.721 . . . . 9.5299999999999994 111.776 -179.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.414 HG23 ' O ' ' B' ' 92' ' ' SER . 9.5 p -68.17 -28.57 41.39 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 C-N-CA 120.861 -0.336 . . . . 8.2200000000000006 110.512 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . 0.418 HG23 ' O ' ' B' ' 61' ' ' PHE . 20.3 t -71.46 -37.25 63.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.01 -0.737 . . . . 7.4299999999999997 109.01 178.113 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 18.3 mtpt -68.82 -37.52 79.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.527 -0.761 . . . . 10.52 110.278 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 48.2 mt -62.02 -49.45 75.99 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.909 -0.587 . . . . 7.5300000000000002 110.292 179.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 22.1 mttt 63.85 112.23 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 O-C-N 124.006 0.816 . . . . 8.0099999999999998 112.46 179.133 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 77.18 23.07 69.46 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.851 -0.69 . . . . 5.8700000000000001 112.72 178.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -129.8 166.16 20.48 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.818 0.342 . . . . 5.6299999999999999 110.697 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' VAL . . . . . 0.632 ' HB ' ' HD1' ' B' ' 93' ' ' PHE . 2.8 p -116.19 120.34 64.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.874 -0.603 . . . . 6.0599999999999996 110.874 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 46.3 tp -107.22 119.5 39.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.914 -0.584 . . . . 4.9299999999999997 109.96 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' SER . . . . . 0.422 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 0.9 OUTLIER -89.38 111.73 22.66 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.97 -0.559 . . . . 6.79 110.781 -179.48 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.4 p -110.84 132.39 59.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.859 -0.423 . . . . 4.4199999999999999 109.859 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 21.7 ttt -106.45 114.96 29.39 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.095 0.474 . . . . 5.6699999999999999 110.972 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.548 ' HE2' ' HD1' ' B' ' 78' ' ' PHE . 49.6 p90 -144.96 -175.35 4.65 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.505 -0.771 . . . . 3.75 108.998 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' ARG . . . . . 0.451 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 40.4 mtm180 -106.7 118.47 36.75 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.048 0.451 . . . . 7.3499999999999996 110.497 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . 0.548 ' HD1' ' HE2' ' B' ' 76' ' ' PHE . 14.8 t80 -97.13 145.66 25.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.297 -0.865 . . . . 5.79 110.201 -179.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' ARG . . . . . 0.531 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 22.4 ttp180 -85.8 129.72 34.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.3 -0.409 . . . . 11.529999999999999 110.676 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' SER . . . . . 0.524 ' HA ' ' HB ' ' B' ' 33' ' ' VAL . 88.6 p -89.77 -177.83 5.35 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.704 -0.48 . . . . 7.4699999999999998 109.704 178.628 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 51.6 tptt -68.47 -23.38 64.58 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.325 0.583 . . . . 12.67 109.547 178.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -86.13 4.66 37.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.631 -0.713 . . . . 9.25 110.349 178.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 67.07 29.23 8.04 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.45 -0.796 . . . . 8.75 111.469 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . 0.448 ' O ' ' HA ' ' B' ' 79' ' ' ARG . 1.7 pt-20 -95.88 152.91 18.07 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.153 -0.684 . . . . 6.8700000000000001 109.153 178.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . 0.531 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 73.2 m95 -104.31 93.89 5.06 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.792 0.33 . . . . 8.3800000000000008 110.384 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . 0.559 HD21 HG11 ' B' ' 33' ' ' VAL . 1.8 pp -96.99 148.8 22.6 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.224 -0.444 . . . . 7.25 110.494 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 87' ' ' TRP . . . . . 0.484 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 90.5 m95 -72.82 121.99 20.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.965 0.412 . . . . 9.3000000000000007 110.581 -179.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 27.2 tpp -122.47 131.62 53.95 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.782 -0.645 . . . . 4.46 110.981 -178.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 15.9 ttp180 -100.38 72.69 1.62 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.517 -0.92 . . . . 7.3099999999999996 108.517 178.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 90' ' ' THR . . . . . 0.502 HG22 ' HB3' ' B' ' 108' ' ' CYS . 54.0 m -66.81 113.02 4.56 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.201 -0.908 . . . . 6.1799999999999997 112.083 -178.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 91' ' ' SER . . . . . 0.422 ' HA ' ' HA ' ' B' ' 73' ' ' SER . 1.6 m -95.1 96.82 9.49 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.935 -0.765 . . . . 6.4500000000000002 108.935 178.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 92' ' ' SER . . . . . 0.457 ' O ' ' HA ' ' B' ' 71' ' ' VAL . 16.3 m -84.06 117.39 23.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.274 -0.421 . . . . 6.75 111.819 -178.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . 0.632 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 71.2 t80 -110.08 122.12 46.84 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.086 -0.506 . . . . 6.4500000000000002 110.161 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -87.3 118.4 26.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.755 0.312 . . . . 9.8800000000000008 111.01 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . 0.448 ' O ' ' HA ' ' B' ' 103' ' ' ILE . 0.0 OUTLIER -83.58 130.9 35.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.811 0.339 . . . . 8.9100000000000001 110.919 -179.837 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -104.71 111.04 23.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.964 -0.562 . . . . 10.99 110.958 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 97' ' ' ASN . . . . . 0.471 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 65.3 t30 -74.32 127.3 87.93 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 109.513 -0.551 . . . . 8.5099999999999998 109.513 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . 0.471 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 62.1 Cg_endo -74.71 20.02 0.45 Allowed 'Trans proline' 0 CA--C 1.535 0.554 0 C-N-CA 122.714 2.276 . . . . 9.1600000000000001 113.884 -179.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -91.69 -56.72 3.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.938 0.399 . . . . 11.390000000000001 110.1 179.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 100' ' ' SER . . . . . 0.406 ' HB2' ' HG3' ' B' ' 102' ' ' GLU . 1.4 m -135.95 16.46 3.28 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.531 -0.544 . . . . 7.9000000000000004 109.531 179.055 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 23.7 t70 63.84 40.26 7.68 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.232 -0.894 . . . . 9.0800000000000001 110.497 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . 0.406 ' HG3' ' HB2' ' B' ' 100' ' ' SER . 0.0 OUTLIER -96.83 158.87 15.22 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.708 -0.678 . . . . 7.71 110.481 179.948 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' ILE . . . . . 0.448 ' HA ' ' O ' ' B' ' 95' ' ' PHE . 68.7 mt -95.44 105.05 16.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.709 -0.478 . . . . 8.3800000000000008 109.709 179.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -60.59 -52.33 65.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.84 -0.618 . . . . 8.8100000000000005 110.962 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -164.37 171.16 15.13 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.613 -0.721 . . . . 7.8200000000000003 110.019 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 37.8 mt -108.47 119.54 58.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.952 -0.567 . . . . 7.2199999999999998 109.951 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 33.5 mt -86.6 97.98 6.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 109.443 -0.577 . . . . 6.7199999999999998 109.443 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' CYS . . . . . 0.502 ' HB3' HG22 ' B' ' 90' ' ' THR . 92.5 m -92.68 104.38 16.66 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.178 0.436 . . . . 5.3099999999999996 112.178 -179.103 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' THR . . . . . 0.408 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 3.5 m -78.28 97.46 5.57 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.606 -0.887 . . . . 5.8700000000000001 108.606 177.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' ASN . . . . . 0.652 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.2 m-20 -80.56 89.02 5.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.012 -0.54 . . . . 6.9000000000000004 111.78 -178.118 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 3.3 m -94.78 112.55 24.28 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.199 -0.455 . . . . 8.9000000000000004 110.496 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 112' ' ' ASN . . . . . 0.599 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 4.2 t-20 -70.49 131.66 44.37 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.068 0.461 . . . . 11.84 110.779 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 93.5 t -104.79 -55.94 5.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.591 -0.732 . . . . 12.4 109.986 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . 0.484 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 42.2 mtpt . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.197 -0.906 . . . . 12.68 109.937 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.9 m . . . . . 0 N--CA 1.477 0.895 0 N-CA-C 109.892 -0.41 . . . . 15.82 109.892 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -91.33 117.22 67.7 Favored Pre-proline 0 C--N 1.325 -0.479 0 N-CA-C 110.239 -0.282 . . . . 15.44 110.239 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -65.75 154.32 74.38 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.572 2.181 . . . . 14.109999999999999 111.94 179.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.7 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.8 OUTLIER -77.35 43.25 0.37 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.229 0.538 . . . . 11.369999999999999 111.33 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.56 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 32.8 tt0 -145.75 126.48 14.33 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.852 -0.796 . . . . 10.59 108.852 -179.306 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.955 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 33.5 p90 -145.35 156.42 43.78 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.088 0.47 . . . . 9.1999999999999993 111.342 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.537 HG21 HG21 ' A' ' 107' ' ' ILE . 21.8 mm -85.31 117.13 29.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.681 -0.69 . . . . 8.9399999999999995 110.995 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.41 ' HB3' ' HE1' ' A' ' 22' ' ' PHE . 0.8 OUTLIER -105.75 92.5 4.2 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.119 -0.492 . . . . 6.1100000000000003 110.294 179.481 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 15' ' ' ARG . 6.4 mtt180 -81.48 117.59 22.03 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.482 -0.562 . . . . 9.4600000000000009 109.482 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.1 p80 -149.16 159.28 44.38 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.921 -0.311 . . . . 10.369999999999999 111.041 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.2 p-10 -80.76 178.06 8.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.308 -0.406 . . . . 13.279999999999999 110.349 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.9 pt -58.56 -28.07 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 113.087 0.773 . . . . 13.970000000000001 113.087 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -75.06 -23.65 58.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.28 0.562 . . . . 13.85 110.878 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 112.84 -7.27 25.74 Favored Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 120.841 -0.695 . . . . 9.6099999999999994 111.748 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.452 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 38.9 mm -66.88 115.19 4.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 110.011 -0.366 . . . . 11.289999999999999 110.011 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.445 ' CZ ' ' HB ' ' A' ' 45' ' ' ILE . 98.0 m-85 -71.37 128.59 36.38 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.953 -0.567 . . . . 10.449999999999999 111.402 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 23.4 p -95.04 -31.59 13.52 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.25 -0.886 . . . . 8.1300000000000008 110.102 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -155.47 132.16 10.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.465 -0.789 . . . . 7.4900000000000002 109.423 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.637 HG21 ' HB2' ' A' ' 40' ' ' LEU . 21.6 t -116.99 143.38 27.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.722 0.296 . . . . 6.4500000000000002 110.972 -179.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.955 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 6.9 t70 -67.23 166.03 14.98 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.76 -0.654 . . . . 7.3099999999999996 110.396 179.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 51.5 m170 -87.82 -13.28 42.58 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.928 0.395 . . . . 12.41 110.648 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.463 HH22 HG23 ' B' ' 107' ' ' ILE . 79.2 mtm180 -81.73 -1.96 48.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.227 -0.442 . . . . 12.19 112.033 -179.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 29.2 p -65.04 -30.45 71.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.945 0.402 . . . . 13.5 111.257 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.402 HG12 HE22 ' A' ' 36' ' ' GLN . 24.7 t -61.47 -39.72 83.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.838 -0.619 . . . . 16.559999999999999 111.665 -179.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.73 -18.19 33.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.703 0.287 . . . . 15.07 111.426 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.3 m -85.09 -53.3 5.36 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.344 -0.389 . . . . 15.26 111.917 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.412 HG23 ' H ' ' A' ' 35' ' ' TYR . 3.7 m -123.5 -15.5 5.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.2 0.445 . . . . 14.18 112.2 -179.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 92.41 -13.82 66.28 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.439 -0.886 . . . . 13.85 111.833 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.412 ' H ' HG23 ' A' ' 33' ' ' VAL . 4.7 m-30 -71.46 133.04 45.6 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.679 -0.26 . . . . 18.59 110.58 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.493 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 37.3 mm-40 -78.25 150.77 77.65 Favored Pre-proline 0 C--N 1.321 -0.668 0 N-CA-C 108.445 -0.946 . . . . 15.890000000000001 108.445 178.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.605 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 74.5 Cg_exo -50.22 -43.17 44.43 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.468 2.112 . . . . 12.26 112.515 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -63.49 -22.51 66.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.001 -0.545 . . . . 13.68 112.099 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.493 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 36.5 mt-10 -74.9 -22.54 58.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.852 0.358 . . . . 17.34 110.922 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.637 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.9 mm? -98.14 -30.07 12.86 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.124 -0.489 . . . . 13.56 110.792 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.605 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 92.3 mt -62.77 108.28 1.14 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 13.42 111.217 -179.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 97.04 2.86 59.21 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.894 -0.67 . . . . 13.390000000000001 112.153 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.79 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 4.1 mmpt? -112.4 158.26 20.04 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 110.331 -0.248 . . . . 17.239999999999998 110.331 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.794 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 15.4 m120 -94.01 135.86 34.91 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.973 -0.38 . . . . 12.77 109.973 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.445 ' HB ' ' CZ ' ' A' ' 22' ' ' PHE . 13.8 tt -63.79 -27.34 42.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.014 0.435 . . . . 12.050000000000001 110.501 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 6.1 p -68.5 -17.72 22.47 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 116.086 -0.507 . . . . 13.390000000000001 111.392 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.794 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 34.9 mt-10 -78.49 -35.04 47.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.939 0.4 . . . . 16.530000000000001 111.143 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.439 ' HE2' ' HB3' ' A' ' 43' ' ' LYS . 48.8 m-85 -95.46 6.44 48.97 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.183 0.516 . . . . 15.83 110.752 -179.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 48.9 t -93.75 154.66 17.65 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.807 -0.633 . . . . 12.01 110.343 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.517 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 3.7 t-160 -62.43 128.44 91.37 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.647 -0.706 . . . . 15.130000000000001 109.512 179.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -44.6 -50.47 8.18 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 123.195 2.597 . . . . 15.83 114.25 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -73.1 -11.56 60.59 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.794 0.294 . . . . 16.690000000000001 111.794 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.517 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 5.5 m-20 -107.29 -0.16 22.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.863 0.363 . . . . 13.16 110.881 -179.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -60.89 -50.21 74.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.046 -0.524 . . . . 16.170000000000002 111.17 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -64.38 -36.05 82.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.786 0.327 . . . . 14.35 110.24 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 29.7 tp -58.1 -45.41 87.27 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.2 0.524 . . . . 12.51 109.744 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.453 HD21 ' HA ' ' A' ' 57' ' ' LEU . 0.4 OUTLIER -68.12 -47.23 68.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.481 -0.781 . . . . 10.08 109.984 179.041 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 36.9 ttt180 -54.26 -47.22 72.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.213 -0.903 . . . . 11.710000000000001 111.279 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -64.61 -43.86 92.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.133 -0.485 . . . . 9.7100000000000009 110.924 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.7 m -60.04 -35.28 74.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.342 -0.39 . . . . 9.5199999999999996 110.645 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.536 ' O ' HG12 ' A' ' 64' ' ' VAL . 7.4 m-85 -65.28 -46.09 81.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.321 -0.4 . . . . 12.109999999999999 110.19 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -66.27 -34.97 79.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.195 0.522 . . . . 10.289999999999999 109.944 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -63.87 -40.67 97.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.667 -0.697 . . . . 10.619999999999999 110.61 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.536 HG12 ' O ' ' A' ' 61' ' ' PHE . 0.4 OUTLIER -70.02 -25.63 28.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 116.564 -0.289 . . . . 10.93 110.872 -179.731 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 61' ' ' PHE . 75.5 t -69.03 -37.79 77.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 109.026 -0.731 . . . . 12.890000000000001 109.026 178.301 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 48.5 mtpt -76.5 -28.52 56.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.252 -0.886 . . . . 16.68 110.242 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.609 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 58.3 mt -71.71 -56.74 5.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.466 . . . . 13.18 110.79 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.4 ' HG3' ' O ' ' A' ' 65' ' ' VAL . 78.7 mttt 62.47 104.96 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 O-C-N 123.727 0.642 . . . . 15.17 112.315 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.04 -4.03 86.58 Favored Glycine 0 N--CA 1.454 -0.16 0 C-N-CA 120.716 -0.754 . . . . 10.01 112.942 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.609 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 7.1 tp-100 -101.53 130.31 47.78 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.67 -0.493 . . . . 10.039999999999999 109.67 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 2.7 p -83.29 107.26 14.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.288 0.566 . . . . 8.5399999999999991 110.251 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 20.1 tp -100.08 110.98 23.28 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.996 -0.547 . . . . 8.1300000000000008 110.312 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.462 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 0.0 OUTLIER -89.23 108.6 19.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.998 -0.546 . . . . 7.8899999999999997 111.096 -179.612 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.3 p -100.36 125.35 54.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.13 -0.486 . . . . 8.1799999999999997 109.758 178.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 23.0 ttt -100.52 106.87 18.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.341 -0.391 . . . . 9.6999999999999993 110.349 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.503 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 46.0 p90 -134.25 -174.47 3.56 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.815 -0.63 . . . . 10.27 110.159 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.475 ' HB2' ' HB2' ' A' ' 50' ' ' HIS . 47.4 mtt180 -105.08 117.14 33.25 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.184 -0.462 . . . . 13.859999999999999 110.195 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.503 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 11.4 t80 -107.03 147.6 29.74 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.019 -0.537 . . . . 9.7300000000000004 109.888 -179.526 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.533 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 35.2 ttp180 -87.9 136.47 32.95 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.852 0.358 . . . . 11.300000000000001 110.885 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.421 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 66.0 p -96.52 -174.39 3.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.103 -0.499 . . . . 11.039999999999999 109.999 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.424 ' HD2' ' HA ' ' A' ' 81' ' ' LYS . 42.1 tptt -70.65 -14.25 62.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.346 0.593 . . . . 13.18 109.841 178.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -92.6 3.1 56.2 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.782 -0.644 . . . . 14.890000000000001 109.624 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 67.4 20.7 9.88 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.4 -0.818 . . . . 12.92 111.172 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.421 ' HG2' ' OG ' ' A' ' 80' ' ' SER . 3.2 pt-20 -96.07 153.47 17.76 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.357 -0.608 . . . . 10.94 109.357 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.533 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 67.1 m95 -100.29 112.17 24.49 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.892 0.377 . . . . 11.77 110.676 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.456 HD11 HD21 ' A' ' 112' ' ' ASN . 1.5 pp -110.02 156.04 21.04 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.241 -0.436 . . . . 11.57 110.643 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.506 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 82.5 m95 -81.67 114.65 20.48 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.197 0.523 . . . . 10.73 110.786 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 38.1 tpp -114.92 131.54 56.84 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.435 -0.802 . . . . 9.7400000000000002 110.886 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.6 ttp180 -101.52 76.84 1.71 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.838 -0.801 . . . . 11.16 108.838 178.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.709 HG23 ' HB3' ' A' ' 108' ' ' CYS . 36.7 m -67.33 109.58 3.2 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.381 -0.827 . . . . 9.5899999999999999 112.066 -178.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.462 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 0.7 OUTLIER -90.25 88.8 7.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.265 -0.879 . . . . 8.8800000000000008 109.442 179.506 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.1 m -74.07 131.27 41.17 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.95 -0.568 . . . . 8.9399999999999995 111.897 -178.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -130.3 122.43 27.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.878 -0.601 . . . . 12.1 110.176 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.26 119.24 18.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.402 -0.363 . . . . 10.16 111.388 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -101.52 106.97 18.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.942 0.401 . . . . 12.6 109.997 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -104.01 152.02 22.53 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.086 -0.506 . . . . 14.6 111.335 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.435 ' HB3' ' OE1' ' A' ' 102' ' ' GLU . 11.4 t-20 -86.3 133.03 41.4 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 108.79 -0.818 . . . . 13.83 108.79 178.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.62 14.4 0.41 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 122.81 2.34 . . . . 15.34 113.898 -178.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -87.29 -54.72 4.15 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.883 0.373 . . . . 16.890000000000001 110.294 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 18.8 m -142.38 19.91 2.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.142 -0.481 . . . . 15.140000000000001 110.179 178.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 18.4 t70 67.93 32.15 5.28 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.703 -0.681 . . . . 14.94 110.561 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.435 ' OE1' ' HB3' ' A' ' 97' ' ' ASN . 1.6 mp0 -76.5 122.6 24.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.014 -0.539 . . . . 12.949999999999999 110.089 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 50.9 mt -70.57 108.56 2.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 109.993 -0.373 . . . . 11.44 109.993 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -72.78 -54.32 9.21 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.057 -0.52 . . . . 11.65 110.281 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -162.4 179.67 7.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.667 -0.697 . . . . 10.35 110.066 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 56.5 mt -115.64 117.89 57.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.222 -0.445 . . . . 10.470000000000001 110.468 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.632 HG23 HH22 ' B' ' 15' ' ' ARG . 33.4 mt -89.5 102.91 13.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.51 -0.552 . . . . 9.3200000000000003 109.51 179.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.709 ' HB3' HG23 ' A' ' 90' ' ' THR . 99.5 m -97.15 112.69 24.36 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.227 0.537 . . . . 10.15 111.828 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.421 HG23 HG23 ' B' ' 13' ' ' ILE . 1.6 m -80.66 98.14 7.56 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 108.652 -0.87 . . . . 11.4 108.652 178.211 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.56 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 4.5 m-20 -80.55 99.84 8.29 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.148 -0.478 . . . . 11.640000000000001 111.544 -178.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.424 HG22 ' HB2' ' A' ' 11' ' ' GLU . 3.1 m -106.22 109.74 21.77 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.863 -0.608 . . . . 11.220000000000001 109.976 178.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . 0.7 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 5.0 t-20 -75.19 134.88 41.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.881 0.372 . . . . 12.98 110.719 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.581 HG11 ' HG3' ' A' ' 114' ' ' LYS . 76.8 t -111.34 -50.55 6.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.91 -0.586 . . . . 15.109999999999999 109.9 179.388 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.581 ' HG3' HG11 ' A' ' 113' ' ' VAL . 61.3 mtpt . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.142 -0.932 . . . . 16.32 110.024 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 41.9 m . . . . . 0 N--CA 1.479 0.996 0 CA-C-O 121.05 0.453 . . . . 7.8399999999999999 109.922 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' GLN . . . . . 0.449 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 26.4 mm-40 -124.88 135.94 27.38 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.287 -0.415 . . . . 7.4900000000000002 110.604 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . 0.457 ' HD2' ' HG2' ' B' ' 28' ' ' ARG . 37.6 Cg_exo -61.06 154.8 54.49 Favored 'Trans proline' 0 CA--C 1.53 0.306 0 C-N-CA 122.763 2.308 . . . . 6.4400000000000004 112.309 179.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.33 46.57 1.05 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.494 0.664 . . . . 5.9800000000000004 110.654 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.624 ' HA ' ' O ' ' B' ' 110' ' ' ASN . 62.3 tt0 -155.68 115.52 3.67 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.168 -0.923 . . . . 5.8499999999999996 108.584 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' PHE . . . . . 0.609 ' HB3' ' HB2' ' B' ' 28' ' ' ARG . 33.9 p90 -137.23 155.99 48.84 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.505 0.557 . . . . 6.4900000000000002 112.505 -178.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . 0.485 HG13 HG21 ' B' ' 107' ' ' ILE . 3.4 tt -84.8 118.94 32.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.42 -0.809 . . . . 6.0199999999999996 110.741 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.76 100.87 10.41 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.042 -0.527 . . . . 5.3700000000000001 110.008 179.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . 0.632 HH22 HG23 ' A' ' 107' ' ' ILE . 9.4 mtp180 -88.88 105.1 17.52 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.882 -0.414 . . . . 9.4600000000000009 109.882 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 34.5 p80 -131.71 155.94 46.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.952 -0.567 . . . . 8.3100000000000005 110.217 -179.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -74.58 173.42 10.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.62 -0.264 . . . . 11.19 110.406 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.5 pt -56.78 -31.15 34.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 N-CA-C 112.846 0.684 . . . . 9.3699999999999992 112.846 -178.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -71.15 -27.52 63.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.021 0.439 . . . . 11.92 111.254 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 117.82 -2.97 17.35 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.565 -0.826 . . . . 8.6799999999999997 112.664 179.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . 0.401 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 19.3 mm -75.31 123.51 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 110.152 -0.314 . . . . 11.16 110.152 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . 0.526 ' CZ ' ' HB ' ' B' ' 45' ' ' ILE . 97.2 m-85 -74.74 130.65 39.87 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.877 0.37 . . . . 8.5999999999999996 111.254 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 19.4 m -102.38 -39.95 6.94 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.982 -0.554 . . . . 7.9100000000000001 110.309 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . 0.434 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 44.0 t80 -152.12 134.03 14.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.945 -0.57 . . . . 8.5 109.897 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 2.0 m -131.56 156.66 42.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.539 -0.301 . . . . 6.5 110.589 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . 0.519 ' HB3' ' HB2' ' B' ' 12' ' ' PHE . 11.8 t70 -81.95 158.98 23.7 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.04 -0.527 . . . . 7.1500000000000004 110.466 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -67.92 -17.7 64.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.306 -0.406 . . . . 9.4100000000000001 111.475 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . 0.624 ' HD2' ' O ' ' B' ' 11' ' ' GLU . 65.5 mtm180 -62.98 -16.82 60.96 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.255 -0.429 . . . . 9.7599999999999998 111.858 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 29.3 p -60.21 -36.3 77.36 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.749 0.309 . . . . 11.56 111.654 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . 0.478 ' O ' ' HA2' ' B' ' 34' ' ' GLY . 47.3 t -63.25 -31.42 52.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.972 -0.558 . . . . 14.01 111.34 -179.231 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -91.16 -21.09 21.34 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.809 0.338 . . . . 12.9 111.308 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 26.0 m -82.92 -57.05 3.46 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.066 0.395 . . . . 12.34 112.066 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' VAL . . . . . 0.556 HG13 ' HD2' ' B' ' 78' ' ' PHE . 0.2 OUTLIER -117.31 -11.68 11.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 111.83 0.307 . . . . 13.869999999999999 111.83 -179.391 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' GLY . . . . . 0.478 ' HA2' ' O ' ' B' ' 30' ' ' VAL . . . 90.01 -0.82 79.57 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.506 -0.854 . . . . 14.369999999999999 112.364 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 -79.57 132.51 36.31 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.654 0.264 . . . . 15.56 111.033 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . 0.439 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 80.8 mm-40 -76.6 147.12 77.96 Favored Pre-proline 0 C--N 1.321 -0.674 0 N-CA-C 107.993 -1.114 . . . . 13.859999999999999 107.993 177.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.623 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 72.5 Cg_exo -49.86 -39.93 48.66 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.561 2.174 . . . . 15.210000000000001 112.878 -179.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -66.93 -17.03 64.72 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.914 -0.584 . . . . 17.82 112.531 -179.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.439 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 33.2 mt-10 -78.74 -32.21 46.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.885 0.374 . . . . 14.42 110.648 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.487 ' O ' ' HB2' ' B' ' 22' ' ' PHE . 1.8 mm? -82.88 -30.7 28.34 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.067 -0.515 . . . . 14.550000000000001 110.985 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . 0.623 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 58.8 mt -61.7 104.8 0.47 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.253 -0.43 . . . . 14.050000000000001 111.668 -179.114 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 100.69 5.81 53.38 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.85 -0.69 . . . . 11.68 112.85 179.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.66 ' HA ' ' HE2' ' B' ' 43' ' ' LYS . 6.1 mmpt? -118.85 157.31 27.86 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.612 0.244 . . . . 14.17 110.68 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' ASN . . . . . 0.765 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 18.8 m120 -93.4 137.1 33.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.235 -0.438 . . . . 10.74 110.177 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . 0.526 ' HB ' ' CZ ' ' B' ' 22' ' ' PHE . 14.1 tt -59.69 -29.42 42.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.143 0.497 . . . . 9.8800000000000008 110.952 179.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 7.9 p -69.63 -20.91 24.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.991 -0.549 . . . . 11.779999999999999 111.401 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . 0.765 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 38.6 mt-10 -74.15 -20.78 60.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.926 0.393 . . . . 11.890000000000001 110.935 -179.56 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -112.04 18.87 18.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.101 0.477 . . . . 14.279999999999999 109.906 179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 51.9 t -102.88 151.62 22.23 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.818 -0.628 . . . . 10.81 110.636 -179.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' HIS . . . . . 0.605 ' HB3' ' HB2' ' B' ' 53' ' ' ASP . 5.0 t-80 -57.36 130.22 80.56 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.835 -0.62 . . . . 12.029999999999999 109.472 178.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -46.49 -45.77 18.66 Favored 'Trans proline' 0 CA--C 1.534 0.481 0 C-N-CA 123.048 2.499 . . . . 11.869999999999999 113.587 -179.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -82.34 6.55 16.66 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.138 0.421 . . . . 9.2799999999999994 112.138 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . 0.605 ' HB2' ' HB3' ' B' ' 50' ' ' HIS . 5.2 m-20 -125.1 -0.7 7.78 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.033 0.444 . . . . 7.5199999999999996 110.498 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -64.4 -46.88 81.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.835 -0.62 . . . . 6.5700000000000003 111.102 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 49.2 tp60 -61.51 -42.16 98.38 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.108 -0.497 . . . . 6.9900000000000002 110.402 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 65.4 tp -59.44 -42.09 91.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.081 -0.509 . . . . 5.1399999999999997 110.28 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . 0.456 HD21 ' HA ' ' B' ' 57' ' ' LEU . 0.5 OUTLIER -62.87 -49.95 72.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.089 -0.505 . . . . 6.8200000000000003 110.043 179.356 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -58.18 -46.04 86.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.435 -0.802 . . . . 8.6899999999999995 111.239 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -62.7 -38.69 91.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.095 -0.502 . . . . 6.46 111.197 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 31.0 m -68.74 -36.79 78.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.149 -0.478 . . . . 5.5899999999999999 110.982 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' PHE . . . . . 0.606 ' O ' HG12 ' B' ' 64' ' ' VAL . 8.2 m-85 -62.51 -46.46 88.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.759 0.314 . . . . 8.3300000000000001 110.738 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -67.04 -27.69 67.6 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.933 0.397 . . . . 7.1500000000000004 110.555 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.534 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 18.2 mt-30 -72.53 -42.06 65.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.048 -0.524 . . . . 9.5299999999999994 110.933 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.606 HG12 ' O ' ' B' ' 61' ' ' PHE . 3.2 p -66.04 -25.13 35.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.802 0.334 . . . . 8.2200000000000006 110.31 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . 0.507 HG23 ' O ' ' B' ' 61' ' ' PHE . 89.3 t -72.22 -32.56 43.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 109.264 -0.643 . . . . 7.4299999999999997 109.264 178.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -71.84 -34.72 69.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.65 -0.704 . . . . 10.52 110.182 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' B' ' 63' ' ' GLN . 24.3 mt -68.94 -51.18 42.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.772 -0.649 . . . . 7.5300000000000002 109.975 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 31.1 mttt 59.44 102.31 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 O-C-N 124.12 0.887 . . . . 8.0099999999999998 112.383 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.63 16.61 54.62 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.649 -0.786 . . . . 5.8700000000000001 112.328 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -126.45 162.16 26.25 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 110.275 -0.269 . . . . 5.6299999999999999 110.275 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' VAL . . . . . 0.401 ' HA ' ' O ' ' B' ' 92' ' ' SER . 24.8 t -106.88 121.09 59.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.342 -0.39 . . . . 6.0599999999999996 111.125 -179.017 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 21.2 tp -115.81 104.09 11.3 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.216 -0.661 . . . . 4.9299999999999997 109.216 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' SER . . . . . 0.491 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.4 m -86.21 117.97 25.37 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.908 -0.587 . . . . 6.79 111.032 -179.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.7 p -103.86 129.05 56.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.024 -0.534 . . . . 4.4199999999999999 110.21 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' MET . . . . . 0.433 ' HE1' ' HB ' ' B' ' 113' ' ' VAL . 10.7 tpt -100.47 117.1 33.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.124 -0.489 . . . . 5.6699999999999999 110.362 -179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -154.31 -171.91 4.03 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.393 -0.367 . . . . 3.75 110.205 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' ARG . . . . . 0.57 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 11.8 mtm180 -108.59 119.33 39.19 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.961 0.41 . . . . 7.3499999999999996 110.62 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . 0.556 ' HD2' HG13 ' B' ' 33' ' ' VAL . 19.5 t80 -102.38 144.78 30.43 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.482 -0.781 . . . . 5.79 110.03 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' ARG . . . . . 0.563 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 35.7 ttp180 -80.34 136.54 36.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.725 0.298 . . . . 11.529999999999999 110.517 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' SER . . . . . 0.698 ' HG ' ' HG2' ' B' ' 84' ' ' GLU . 88.9 p -99.26 -176.34 3.27 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.866 -0.42 . . . . 7.4699999999999998 109.866 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . 0.415 ' HD2' ' HA ' ' B' ' 81' ' ' LYS . 32.2 tptt -70.19 -10.42 58.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.566 0.698 . . . . 12.67 109.688 178.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 33.2 m-20 -96.39 3.49 52.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.416 -0.811 . . . . 9.25 109.796 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 67.49 17.5 10.04 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.511 -0.768 . . . . 8.75 111.327 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . 0.698 ' HG2' ' HG ' ' B' ' 80' ' ' SER . 7.1 pt-20 -94.91 158.94 15.26 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.236 -0.653 . . . . 6.8700000000000001 109.236 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . 0.57 ' HB3' ' HB3' ' B' ' 77' ' ' ARG . 42.2 m95 -106.48 108.65 20.27 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 121.03 -0.268 . . . . 8.3800000000000008 110.631 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' B' ' 77' ' ' ARG . 1.9 pp -105.57 152.68 22.77 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.345 -0.388 . . . . 7.25 110.129 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 87' ' ' TRP . . . . . 0.79 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 95.1 m95 -80.88 120.32 24.56 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.034 0.445 . . . . 9.3000000000000007 110.835 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 2.0 ttp -132.0 140.48 48.95 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.929 -0.578 . . . . 4.46 110.889 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 28.5 ttp180 -103.01 93.89 5.26 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.776 -0.647 . . . . 7.3099999999999996 109.36 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 90' ' ' THR . . . . . 0.543 ' CG2' ' HB3' ' B' ' 108' ' ' CYS . 6.4 m -78.47 105.37 9.69 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.014 -0.539 . . . . 6.1799999999999997 111.281 -179.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 91' ' ' SER . . . . . 0.491 ' HA ' ' HA ' ' B' ' 73' ' ' SER . 0.9 OUTLIER -84.05 94.86 8.41 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.65 -0.704 . . . . 6.4500000000000002 109.973 179.657 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 92' ' ' SER . . . . . 0.401 ' O ' ' HA ' ' B' ' 71' ' ' VAL . 8.6 m -84.73 127.18 33.98 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.366 -0.379 . . . . 6.75 111.939 -178.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -125.24 131.0 53.2 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.21 -0.45 . . . . 6.4500000000000002 109.904 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 94' ' ' THR . . . . . 0.448 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.0 OUTLIER -89.28 114.36 25.72 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.472 -0.331 . . . . 9.8800000000000008 110.797 179.644 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -102.45 122.81 45.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.917 0.389 . . . . 8.9100000000000001 110.423 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -106.6 147.65 29.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.968 -0.56 . . . . 10.99 110.533 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 97' ' ' ASN . . . . . 0.427 ' HB3' ' CD2' ' B' ' 99' ' ' TYR . 3.4 m-80 -85.11 147.25 47.26 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 115.972 -0.558 . . . . 8.5099999999999998 110.221 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -78.61 49.83 3.21 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.8 2.333 . . . . 9.1600000000000001 112.999 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . 0.427 ' CD2' ' HB3' ' B' ' 97' ' ' ASN . 51.3 m-85 -128.71 -58.14 1.17 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.999 0.428 . . . . 11.390000000000001 110.366 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.13 21.01 2.8 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.191 -0.459 . . . . 7.9000000000000004 110.538 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 32.7 t70 62.83 32.76 15.7 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.779 0.8 . . . . 9.0800000000000001 110.005 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -85.7 140.42 30.54 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.481 -0.781 . . . . 7.71 110.783 -179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 25.5 mt -84.94 117.74 30.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.322 -0.399 . . . . 8.3800000000000008 110.028 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -75.7 -46.37 31.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.909 0.385 . . . . 8.8100000000000005 110.045 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -165.49 172.48 12.05 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.796 -0.638 . . . . 7.8200000000000003 109.643 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 54.3 mt -106.37 115.89 48.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 109.952 -0.388 . . . . 7.2199999999999998 109.952 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . 0.485 HG21 HG13 ' B' ' 13' ' ' ILE . 77.0 mt -81.9 105.55 11.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.753 -0.658 . . . . 6.7199999999999998 109.741 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' CYS . . . . . 0.543 ' HB3' ' CG2' ' B' ' 90' ' ' THR . 94.4 m -107.85 99.0 8.51 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 120.863 0.363 . . . . 5.3099999999999996 111.948 -179.101 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 94.4 m -75.64 105.54 6.73 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.413 -0.958 . . . . 5.8700000000000001 108.413 177.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' ASN . . . . . 0.624 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 3.7 m-20 -81.85 101.18 10.03 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.718 -0.674 . . . . 6.9000000000000004 111.671 -178.108 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 20.4 m -101.56 107.43 18.71 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.814 -0.63 . . . . 8.9000000000000004 110.301 179.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -70.86 135.76 48.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.787 0.327 . . . . 11.84 110.502 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . 0.433 ' HB ' ' HE1' ' B' ' 75' ' ' MET . 37.1 t -113.37 -53.46 5.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.005 -0.543 . . . . 12.4 110.009 179.535 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . 0.79 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 46.4 mtpt . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.283 -0.865 . . . . 12.68 109.817 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.0 m . . . . . 0 N--CA 1.476 0.842 0 N-CA-C 110.011 -0.366 . . . . 15.82 110.011 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 78.6 mm-40 -109.06 109.0 60.89 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 109.582 -0.525 . . . . 15.44 109.582 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -61.12 150.83 82.5 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 123.089 2.526 . . . . 14.109999999999999 112.32 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.807 HG21 ' HA ' ' A' ' 32' ' ' THR . 0.0 OUTLIER -82.96 51.39 1.92 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.27 0.557 . . . . 11.369999999999999 110.8 -179.861 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.622 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 30.7 tt0 -153.71 116.26 4.42 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.602 -0.888 . . . . 10.59 108.602 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.967 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 41.3 p90 -130.95 166.39 21.07 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.984 0.421 . . . . 9.1999999999999993 111.579 -178.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.53 HD11 HG21 ' A' ' 109' ' ' THR . 30.9 mm -94.77 121.28 45.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.854 -0.612 . . . . 8.9399999999999995 110.665 -179.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.613 ' HB3' ' HE2' ' A' ' 22' ' ' PHE . 0.7 OUTLIER -106.54 97.1 6.93 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.159 -0.473 . . . . 6.1100000000000003 110.878 179.588 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.411 ' HB2' ' HB3' ' A' ' 24' ' ' PHE . 3.5 mtt180 -83.17 102.41 11.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.763 -0.829 . . . . 9.4600000000000009 108.763 178.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.428 ' O ' ' HB2' ' A' ' 105' ' ' TYR . 34.4 p80 -132.18 158.7 41.03 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 121.149 -0.22 . . . . 10.369999999999999 111.265 -178.555 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -77.92 178.23 7.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.487 -0.324 . . . . 13.279999999999999 110.235 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 22.2 pt -54.55 -37.04 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 113.374 0.879 . . . . 13.970000000000001 113.374 -178.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -73.17 -25.66 60.88 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.039 0.447 . . . . 13.85 111.568 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 116.35 1.09 20.39 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.449 -0.882 . . . . 9.6099999999999994 112.198 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.424 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 37.0 mm -67.89 114.37 4.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 109.728 -0.471 . . . . 11.289999999999999 109.728 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.613 ' HE2' ' HB3' ' A' ' 14' ' ' SER . 78.8 m-85 -67.32 126.27 28.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.143 -0.48 . . . . 10.449999999999999 110.907 -179.703 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.2 m -106.29 -26.02 11.7 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.68 -0.691 . . . . 8.1300000000000008 109.754 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.458 ' HE2' ' HE1' ' B' ' 95' ' ' PHE . 78.1 t80 -152.42 116.2 4.83 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.646 -0.706 . . . . 7.4900000000000002 109.615 179.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.581 HG21 ' HB2' ' A' ' 40' ' ' LEU . 19.3 t -112.27 127.48 69.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.347 -0.388 . . . . 6.4500000000000002 110.763 -179.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.967 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 10.1 t70 -66.38 136.28 55.54 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.145 -0.48 . . . . 7.3099999999999996 110.08 179.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -57.61 -16.3 9.99 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.896 0.702 . . . . 12.41 112.896 -179.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.43 ' HB2' ' HB3' ' A' ' 12' ' ' PHE . 80.1 mtm180 -67.95 -10.57 54.51 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.216 -0.302 . . . . 12.19 111.077 179.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 29.1 p -59.89 -31.46 69.82 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.726 0.298 . . . . 13.5 110.914 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 20.4 t -65.01 -36.55 78.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.185 -0.461 . . . . 16.559999999999999 110.823 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.05 -16.27 38.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.933 0.397 . . . . 15.07 110.922 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.807 ' HA ' HG21 ' A' ' 10' ' ' THR . 25.8 m -87.97 -56.64 3.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.019 -0.537 . . . . 15.26 111.594 -179.579 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.631 ' HB ' ' HA ' ' A' ' 80' ' ' SER . 7.7 m -121.47 -19.41 4.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 111.924 0.342 . . . . 14.18 111.924 -179.49 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.2 -18.27 56.82 Favored Glycine 0 N--CA 1.454 -0.145 0 C-N-CA 120.602 -0.809 . . . . 13.85 112.273 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -66.37 136.92 56.46 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.624 0.249 . . . . 18.59 110.483 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.481 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 33.6 mm-40 -76.24 150.6 83.01 Favored Pre-proline 0 C--N 1.326 -0.437 0 N-CA-C 109.37 -0.604 . . . . 15.890000000000001 109.37 179.207 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.527 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 52.6 Cg_exo -52.47 -41.97 64.27 Favored 'Trans proline' 0 CA--C 1.527 0.162 0 C-N-CA 122.529 2.153 . . . . 12.26 112.528 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.467 ' HA ' HD12 ' A' ' 41' ' ' LEU . 23.4 mp0 -69.24 -19.19 63.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.025 -0.534 . . . . 13.68 111.839 -179.174 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.481 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 36.7 mt-10 -73.45 -24.05 60.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.945 0.402 . . . . 17.34 110.426 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.581 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.8 mm? -93.45 -28.49 16.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.071 -0.513 . . . . 13.56 110.286 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 91.8 mt -61.17 131.8 51.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.925 -0.579 . . . . 13.42 110.772 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 75.99 11.72 84.54 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.928 -0.653 . . . . 13.390000000000001 112.681 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.762 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 7.9 mmpt? -129.47 159.61 35.74 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.696 0.284 . . . . 17.239999999999998 110.388 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -94.02 138.23 32.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.157 -0.474 . . . . 12.77 110.197 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 17.2 tt -60.25 -25.7 34.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.013 -0.539 . . . . 12.050000000000001 111.3 179.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.8 p -68.38 -20.84 25.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 116.342 -0.39 . . . . 13.390000000000001 111.413 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -76.99 -23.62 52.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.048 0.451 . . . . 16.530000000000001 110.4 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -106.11 15.09 26.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.885 -0.598 . . . . 15.83 109.984 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 17.1 t -106.62 147.98 28.86 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.461 -0.79 . . . . 12.01 110.843 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . . . . . . . . . 7.4 t-160 -57.76 127.76 79.19 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 115.58 -0.736 . . . . 15.130000000000001 109.36 178.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -45.18 -52.17 6.82 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.475 2.783 . . . . 15.83 113.976 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -67.67 -8.91 38.77 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.315 0.487 . . . . 16.690000000000001 112.315 -179.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.506 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 27.8 m-20 -114.84 -1.48 13.18 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.793 0.33 . . . . 13.16 110.893 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -62.39 -46.2 89.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.24 -0.436 . . . . 16.170000000000002 111.099 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -63.01 -38.19 90.19 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.64 -0.504 . . . . 14.35 109.64 178.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.3 tp -61.7 -43.35 99.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.626 -0.716 . . . . 12.51 109.925 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.438 HD21 ' HA ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -63.99 -52.52 59.2 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.781 -0.645 . . . . 10.08 110.706 179.487 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 33.6 ttt180 -58.22 -46.3 86.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.319 -0.4 . . . . 11.710000000000001 111.385 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.46 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 34.7 t70 -61.5 -45.58 93.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.71 -0.223 . . . . 9.7100000000000009 110.914 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 45.2 m -63.61 -37.53 87.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.972 0.415 . . . . 9.5199999999999996 110.557 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.493 ' O ' HG12 ' A' ' 64' ' ' VAL . 2.8 m-30 -63.3 -37.33 86.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.106 -0.497 . . . . 12.109999999999999 109.993 178.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 -73.32 -33.06 64.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.182 -0.463 . . . . 10.289999999999999 109.92 178.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.46 ' HG3' ' O ' ' A' ' 59' ' ' ASP . 52.9 mt-30 -63.53 -45.33 91.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.878 -0.601 . . . . 10.619999999999999 110.991 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.493 HG12 ' O ' ' A' ' 61' ' ' PHE . 6.3 p -65.29 -25.23 36.71 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-N 116.538 -0.301 . . . . 10.93 111.472 -179.231 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 61' ' ' PHE . 79.5 t -70.82 -32.77 50.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 109.405 -0.591 . . . . 12.890000000000001 109.405 178.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 34.8 mtpt -82.56 -18.31 41.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.43 -0.805 . . . . 16.68 110.245 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 92.1 mt -83.03 -54.16 5.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.012 -0.54 . . . . 13.18 109.967 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 57.6 mttt 61.4 94.98 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.914 0.759 . . . . 15.17 112.814 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 107.17 -25.48 21.87 Favored Glycine 0 N--CA 1.454 -0.109 0 C-N-CA 120.423 -0.894 . . . . 10.01 113.753 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -90.33 131.54 36.07 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.156 -0.313 . . . . 10.039999999999999 110.156 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.446 ' HB ' ' HZ ' ' B' ' 24' ' ' PHE . 3.7 p -77.54 113.07 16.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.269 0.557 . . . . 8.5399999999999991 110.491 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 33.3 tp -102.19 100.16 10.34 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.038 -0.528 . . . . 8.1300000000000008 110.602 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.432 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 0.0 OUTLIER -81.66 115.01 20.72 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.607 -0.724 . . . . 7.8899999999999997 110.363 179.478 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 p -109.52 122.95 64.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.915 0.388 . . . . 8.1799999999999997 110.172 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 27.7 ttt -97.17 111.96 23.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.261 -0.427 . . . . 9.6999999999999993 111.065 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.506 ' HB2' ' HB3' ' A' ' 53' ' ' ASP . 48.3 p90 -140.49 -173.47 3.69 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.195 -0.669 . . . . 10.27 109.195 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.442 ' HB3' ' HB3' ' A' ' 85' ' ' TRP . 12.9 mtm180 -105.59 122.17 45.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.105 0.479 . . . . 13.859999999999999 110.649 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -104.27 152.61 22.01 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.671 -0.695 . . . . 9.7300000000000004 110.203 -179.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.613 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 46.9 ttp180 -92.83 128.43 38.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.871 0.367 . . . . 11.300000000000001 111.018 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.631 ' HA ' ' HB ' ' A' ' 33' ' ' VAL . 77.5 p -90.76 -176.63 4.75 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.698 -0.482 . . . . 11.039999999999999 109.698 179.117 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.422 ' HD2' ' HA ' ' A' ' 81' ' ' LYS . 40.3 tptt -71.41 -12.2 61.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.376 0.608 . . . . 13.18 109.614 178.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -90.84 2.98 55.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.404 -0.816 . . . . 14.890000000000001 109.342 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 65.24 23.72 12.22 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 115.029 -0.987 . . . . 12.92 111.104 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.486 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.6 pt-20 -99.2 160.15 14.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 10.94 109.888 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.613 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 64.8 m95 -106.47 110.66 22.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.521 -0.309 . . . . 11.77 110.638 -179.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -113.72 154.94 26.47 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.264 -0.426 . . . . 11.57 110.072 179.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.442 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 97.9 m95 -75.04 120.5 20.65 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.247 0.546 . . . . 10.73 111.416 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 47.8 tpp -119.44 130.71 55.4 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.221 -0.9 . . . . 9.7400000000000002 110.416 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.493 ' HB3' ' HB ' ' A' ' 111' ' ' THR . 3.1 ttp180 -101.87 73.97 1.44 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.042 -0.725 . . . . 11.16 109.042 178.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.629 HG22 ' HB3' ' A' ' 108' ' ' CYS . 52.3 m -64.34 114.43 4.27 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.694 -0.685 . . . . 9.5899999999999999 111.651 -179.242 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.58 ' O ' ' HA ' ' A' ' 108' ' ' CYS . 0.7 OUTLIER -89.75 94.45 9.84 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.385 -0.825 . . . . 8.8800000000000008 109.873 179.948 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.434 ' HA ' ' SG ' ' A' ' 108' ' ' CYS . 5.3 m -77.5 117.45 18.96 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.982 0.42 . . . . 8.9399999999999995 111.532 -179.057 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -122.91 117.55 25.82 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.837 -0.619 . . . . 12.1 109.77 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.56 127.75 33.6 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.227 -0.442 . . . . 10.16 111.664 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -104.03 118.53 36.89 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.586 -0.524 . . . . 12.6 109.586 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -108.54 149.17 29.22 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.215 0.531 . . . . 14.6 111.928 -178.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.455 ' HA ' ' HD3' ' A' ' 98' ' ' PRO . 12.0 t-20 -97.19 132.89 24.75 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 115.36 -0.836 . . . . 13.83 109.612 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 97' ' ' ASN . 27.5 Cg_exo -63.27 -6.31 9.74 Favored 'Trans proline' 0 N--CA 1.476 0.486 0 C-N-CA 123.358 2.705 . . . . 15.34 114.467 -178.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -62.84 -61.51 2.36 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.643 0.258 . . . . 16.890000000000001 110.436 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -145.31 27.95 1.23 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.736 0.303 . . . . 15.140000000000001 111.0 179.096 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 27.7 t70 63.52 41.9 7.0 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.529 -0.759 . . . . 14.94 111.782 179.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -91.36 142.47 27.65 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.351 -0.386 . . . . 12.949999999999999 110.067 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 48.9 mt -88.75 102.3 12.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.047 -0.353 . . . . 11.44 110.047 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -71.26 -41.37 70.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.71 0.291 . . . . 11.65 110.974 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.428 ' HB2' ' O ' ' A' ' 16' ' ' HIS . 20.6 p90 -161.6 178.96 8.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.777 0.322 . . . . 10.35 110.642 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 44.4 mt -122.24 123.24 68.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.092 -0.504 . . . . 10.470000000000001 110.634 -179.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.574 HG23 HH22 ' B' ' 15' ' ' ARG . 85.8 mt -91.12 112.7 25.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.11 -0.7 . . . . 9.3200000000000003 109.11 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.629 ' HB3' HG22 ' A' ' 90' ' ' THR . 96.8 m -113.76 116.59 29.63 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.372 0.508 . . . . 10.15 112.372 -178.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.539 HG23 HG13 ' B' ' 13' ' ' ILE . 0.2 OUTLIER -82.92 110.55 18.0 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.69 -0.856 . . . . 11.4 108.69 177.865 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.622 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 3.9 m-20 -85.56 98.33 10.58 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.882 0.372 . . . . 11.640000000000001 111.448 -178.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' THR . . . . . 0.493 ' HB ' ' HB3' ' A' ' 89' ' ' ARG . 1.3 m -93.75 110.55 22.18 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.756 -0.657 . . . . 11.220000000000001 111.165 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . 0.791 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 3.8 t-20 -75.64 111.93 11.48 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.588 -0.523 . . . . 12.98 109.588 178.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . 0.467 HG11 ' HG3' ' A' ' 114' ' ' LYS . 39.5 t -91.4 -53.41 8.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 116.072 -0.513 . . . . 15.109999999999999 110.488 -179.578 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.467 ' HG3' HG11 ' A' ' 113' ' ' VAL . 54.7 mtpt . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.406 -0.806 . . . . 16.32 110.056 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 18.8 m . . . . . 0 N--CA 1.478 0.96 0 CA-C-O 120.716 0.294 . . . . 7.8399999999999999 110.295 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' GLN . . . . . 0.738 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 33.5 mm-40 -75.81 146.18 79.24 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.386 -0.37 . . . . 7.4900000000000002 110.94 -179.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' B' ' 8' ' ' GLN . 5.5 Cg_exo -80.54 -167.41 0.5 Allowed 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 123.276 2.651 . . . . 6.4400000000000004 112.812 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' THR . . . . . 0.715 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.1 OUTLIER -99.32 47.04 0.96 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.218 0.532 . . . . 5.9800000000000004 110.936 -179.707 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.508 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -151.76 151.53 31.51 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.543 -0.91 . . . . 5.8499999999999996 108.543 179.593 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' PHE . . . . . 0.609 ' HB2' ' HB3' ' B' ' 26' ' ' ASP . 18.8 p90 -161.32 158.72 27.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.412 0.625 . . . . 6.4900000000000002 112.019 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . 0.539 HG13 HG23 ' A' ' 109' ' ' THR . 24.7 mm -85.51 118.81 32.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.091 -0.959 . . . . 6.0199999999999996 110.542 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.424 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.8 OUTLIER -112.79 89.2 3.01 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.199 -0.455 . . . . 5.3700000000000001 110.761 179.9 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . 0.574 HH22 HG23 ' A' ' 107' ' ' ILE . 8.1 mtp180 -83.4 110.83 18.48 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.387 -0.597 . . . . 9.4600000000000009 109.387 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . 0.494 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 33.6 p80 -136.68 162.53 32.9 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.548 -0.296 . . . . 8.3100000000000005 110.616 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -78.14 174.97 10.59 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.208 -0.293 . . . . 11.19 110.208 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 27.0 pt -59.71 -24.11 28.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 113.109 0.781 . . . . 9.3699999999999992 113.109 -178.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -77.54 -22.01 51.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.935 0.398 . . . . 11.92 110.981 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 112.72 -7.82 25.94 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.558 -0.83 . . . . 8.6799999999999997 112.368 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 33.9 mm -69.71 116.71 11.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 110.186 -0.301 . . . . 11.16 110.186 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . 0.494 ' HA ' ' HB3' ' B' ' 16' ' ' HIS . 94.7 m-85 -66.13 121.4 15.07 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.091 -0.504 . . . . 8.5999999999999996 111.106 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -92.19 -40.25 11.11 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.779 -0.646 . . . . 7.9100000000000001 110.363 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . 0.446 ' HZ ' ' HB ' ' A' ' 71' ' ' VAL . 47.6 t80 -155.44 120.87 4.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.101 -0.499 . . . . 8.5 110.29 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 10.6 m -115.86 154.68 17.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.032 0.444 . . . . 6.5 111.218 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . 0.609 ' HB3' ' HB2' ' B' ' 12' ' ' PHE . 9.2 t70 -74.47 165.03 25.88 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.428 -0.806 . . . . 7.1500000000000004 110.233 179.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 4.2 m170 -82.27 -8.7 59.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.838 0.352 . . . . 9.4100000000000001 110.981 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . 0.738 ' HG2' ' HB3' ' B' ' 8' ' ' GLN . 72.1 mtm180 -69.1 -14.62 63.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.006 -0.543 . . . . 9.7599999999999998 111.974 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 28.4 p -57.28 -31.66 65.84 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 111.725 0.269 . . . . 11.56 111.725 -178.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 25.1 t -63.05 -38.74 82.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.205 -0.452 . . . . 14.01 111.108 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.04 -17.57 30.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.771 0.32 . . . . 12.9 110.968 179.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 41.5 m -80.39 -58.82 2.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.167 -0.47 . . . . 12.34 111.849 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' VAL . . . . . 0.484 ' HB ' ' HA ' ' B' ' 80' ' ' SER . 3.5 m -127.68 -2.07 3.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 112.24 0.459 . . . . 13.869999999999999 112.24 -178.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.29 -19.94 28.85 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.705 -0.759 . . . . 14.369999999999999 112.564 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' TYR . . . . . 0.448 ' HB2' HG22 ' B' ' 33' ' ' VAL . 4.2 m-85 -62.95 129.63 41.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.708 0.29 . . . . 15.56 110.668 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . 0.575 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 40.4 mm-40 -73.74 151.89 89.1 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 109.54 -0.541 . . . . 13.859999999999999 109.54 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.494 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 61.3 Cg_exo -51.58 -38.86 65.85 Favored 'Trans proline' 0 CA--C 1.53 0.32 0 C-N-CA 122.757 2.304 . . . . 15.210000000000001 112.778 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 24.3 mp0 -71.44 -13.38 61.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.883 -0.599 . . . . 17.82 111.821 -179.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.575 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 30.4 mt-10 -85.14 -19.8 31.24 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.8 0.333 . . . . 14.42 110.293 179.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -92.24 -45.1 8.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.016 -0.538 . . . . 14.550000000000001 110.377 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 51.5 mt -58.56 126.39 27.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.009 -0.541 . . . . 14.050000000000001 111.211 -179.249 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.53 -5.16 83.99 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.778 -0.646 . . . . 11.68 112.261 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.797 ' HA ' ' HE2' ' B' ' 43' ' ' LYS . 6.7 mmpt? -112.05 160.05 17.87 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 122.758 -0.26 . . . . 14.17 110.433 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' ASN . . . . . 0.806 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 17.7 m120 -92.61 138.12 31.78 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.601 -0.518 . . . . 10.74 109.601 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . 0.424 ' HB ' ' CZ ' ' B' ' 22' ' ' PHE . 14.4 tt -62.9 -28.07 44.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.034 0.445 . . . . 9.8800000000000008 111.055 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 5.1 p -71.5 -18.64 20.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-N 116.224 -0.444 . . . . 11.779999999999999 111.72 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . 0.806 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 42.9 mt-10 -69.57 -37.41 76.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.902 0.382 . . . . 11.890000000000001 110.968 -179.344 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 -98.74 18.19 17.53 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.023 0.439 . . . . 14.279999999999999 110.405 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 41.1 t -101.65 145.67 28.77 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.888 -0.596 . . . . 10.81 110.616 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' HIS . . . . . 0.466 ' CD2' ' HD2' ' B' ' 51' ' ' PRO . 5.5 t-160 -55.64 128.61 69.32 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.537 -0.756 . . . . 12.029999999999999 109.92 178.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' PRO . . . . . 0.466 ' HD2' ' CD2' ' B' ' 50' ' ' HIS . 95.7 Cg_exo -44.57 -51.72 6.81 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 123.516 2.811 . . . . 11.869999999999999 113.628 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -70.07 -4.19 19.98 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.184 0.439 . . . . 9.2799999999999994 112.184 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 -120.54 -0.32 10.32 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.866 0.365 . . . . 7.5199999999999996 110.502 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -62.72 -43.51 98.62 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.97 -0.559 . . . . 6.5700000000000003 111.209 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 48.6 tp60 -69.41 -39.31 77.97 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.425 -0.352 . . . . 6.9900000000000002 110.189 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 58.0 tp -59.64 -39.81 85.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 5.1399999999999997 110.483 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . 0.428 HD22 ' CZ ' ' B' ' 61' ' ' PHE . 0.7 OUTLIER -62.85 -50.42 71.0 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.003 -0.544 . . . . 6.8200000000000003 110.33 179.267 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 52.8 ttt180 -61.43 -43.45 98.85 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.103 -0.499 . . . . 8.6899999999999995 110.923 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . 0.429 ' O ' ' HG3' ' B' ' 63' ' ' GLN . 25.3 t70 -60.0 -46.52 89.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.812 0.339 . . . . 6.46 110.296 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 36.6 m -61.42 -34.2 74.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.959 -0.564 . . . . 5.5899999999999999 110.426 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' PHE . . . . . 0.508 ' O ' HG23 ' B' ' 65' ' ' VAL . 10.7 m-85 -65.35 -39.8 92.82 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.295 0.569 . . . . 8.3300000000000001 109.535 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -67.4 -35.55 79.52 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.802 -0.636 . . . . 7.1500000000000004 110.171 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.429 ' HG3' ' O ' ' B' ' 59' ' ' ASP . 34.8 mt-30 -69.28 -44.51 71.69 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.941 -0.572 . . . . 9.5299999999999994 111.514 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.544 ' HA ' HD12 ' B' ' 67' ' ' LEU . 9.9 p -63.49 -29.22 46.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-O 120.719 0.295 . . . . 8.2200000000000006 110.692 -179.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . 0.666 ' HA ' HG21 ' B' ' 94' ' ' THR . 61.3 t -70.44 -35.48 62.24 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.1 0 N-CA-C 109.638 -0.505 . . . . 7.4299999999999997 109.638 178.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -67.66 -39.97 84.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.843 -0.617 . . . . 10.52 110.039 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.544 HD12 ' HA ' ' B' ' 64' ' ' VAL . 25.6 mt -66.17 -49.0 68.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.564 -0.744 . . . . 7.5300000000000002 110.082 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 14.6 tttt 60.75 98.41 0.03 OUTLIER 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.474 -0.785 . . . . 8.0099999999999998 112.228 179.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.83 20.36 34.16 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.751 -0.738 . . . . 5.8700000000000001 112.427 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -124.89 154.06 41.67 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.569 -0.53 . . . . 5.6299999999999999 109.569 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' VAL . . . . . 0.575 ' CG2' ' HB3' ' B' ' 91' ' ' SER . 2.7 p -103.96 117.36 49.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-O 121.283 0.564 . . . . 6.0599999999999996 110.582 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 13.0 tp -108.86 111.05 22.56 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.773 -0.649 . . . . 4.9299999999999997 110.09 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' SER . . . . . 0.582 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 12.7 m -87.06 112.18 21.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.233 -0.44 . . . . 6.79 111.117 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.2 p -108.82 131.19 60.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.039 -0.528 . . . . 4.4199999999999999 110.061 179.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 25.4 ttt -100.85 115.11 29.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.077 0.465 . . . . 5.6699999999999999 110.912 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.496 ' HE1' ' HB ' ' B' ' 90' ' ' THR . 50.7 p90 -143.99 178.17 8.04 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.649 -0.705 . . . . 3.75 109.456 179.662 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' ARG . . . . . 0.543 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 12.1 mtm180 -101.09 122.23 43.21 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.998 0.428 . . . . 7.3499999999999996 110.112 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . 0.431 ' HD1' ' HE2' ' B' ' 76' ' ' PHE . 25.5 t80 -105.78 145.81 30.68 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.604 -0.726 . . . . 5.79 110.119 -179.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' ARG . . . . . 0.533 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 30.4 ttt180 -87.22 122.35 30.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.141 -0.481 . . . . 11.529999999999999 110.782 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' SER . . . . . 0.484 ' HA ' ' HB ' ' B' ' 33' ' ' VAL . 76.5 p -86.37 -176.81 6.03 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.085 -0.507 . . . . 7.4699999999999998 109.746 179.028 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -70.63 -13.06 61.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.496 0.665 . . . . 12.67 109.581 178.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -88.61 0.03 56.79 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.595 -0.73 . . . . 9.25 109.626 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 69.76 20.19 6.93 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.393 -0.821 . . . . 8.75 110.832 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . 0.423 ' O ' ' HA ' ' B' ' 79' ' ' ARG . 2.8 pt-20 -98.94 151.4 20.93 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.348 -0.387 . . . . 6.8700000000000001 110.118 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . 0.543 ' HB3' ' HB3' ' B' ' 77' ' ' ARG . 44.2 m95 -100.76 103.2 14.43 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.246 -0.434 . . . . 8.3800000000000008 110.587 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . 0.405 ' O ' ' HA ' ' B' ' 77' ' ' ARG . 0.8 OUTLIER -103.46 151.84 22.35 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.221 -0.445 . . . . 7.25 110.346 179.642 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 87' ' ' TRP . . . . . 0.688 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 89.7 m95 -76.37 114.4 15.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.246 0.546 . . . . 9.3000000000000007 110.759 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 88' ' ' MET . . . . . 0.417 ' HE1' ' HB2' ' B' ' 88' ' ' MET . 21.4 tpp -115.21 129.89 56.77 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.216 -0.902 . . . . 4.46 110.792 -178.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 -99.49 85.07 3.08 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.566 -0.901 . . . . 7.3099999999999996 108.566 178.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 90' ' ' THR . . . . . 0.496 ' HB ' ' HE1' ' B' ' 76' ' ' PHE . 22.7 m -78.82 113.19 16.7 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.759 -0.655 . . . . 6.1799999999999997 111.86 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 91' ' ' SER . . . . . 0.613 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 20.3 m -93.66 87.7 5.58 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.63 -0.714 . . . . 6.4500000000000002 109.815 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 92' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' B' ' 108' ' ' CYS . 14.4 m -72.74 128.75 36.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.903 -0.59 . . . . 6.75 111.419 -178.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -122.71 126.41 47.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.106 -0.497 . . . . 6.4500000000000002 110.021 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 94' ' ' THR . . . . . 0.666 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.1 OUTLIER -83.3 107.7 16.01 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.709 0.29 . . . . 9.8800000000000008 110.501 179.406 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . 0.458 ' HE1' ' HE2' ' A' ' 24' ' ' PHE . 0.3 OUTLIER -86.27 129.73 34.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.381 -0.372 . . . . 8.9100000000000001 110.558 -179.466 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -108.48 131.51 54.74 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.011 -0.54 . . . . 10.99 111.028 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 97' ' ' ASN . . . . . 0.434 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 55.9 t30 -71.49 127.9 90.59 Favored Pre-proline 0 C--N 1.32 -0.706 0 N-CA-C 108.866 -0.79 . . . . 8.5099999999999998 108.866 178.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . 0.434 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 57.4 Cg_endo -70.37 45.39 0.52 Allowed 'Trans proline' 0 CA--C 1.534 0.501 0 C-N-CA 123.175 2.583 . . . . 9.1600000000000001 113.137 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -126.53 -54.22 1.45 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.44 -0.345 . . . . 11.390000000000001 110.702 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 48.5 m -137.11 21.43 3.01 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.745 -0.207 . . . . 7.9000000000000004 111.201 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 25.4 t70 64.8 20.2 12.06 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 121.525 0.679 . . . . 9.0800000000000001 110.492 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 4.3 pm0 -79.95 142.51 35.01 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.083 -0.508 . . . . 7.71 110.477 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 80.8 mt -76.53 110.86 12.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.751 -0.463 . . . . 8.3800000000000008 109.751 179.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -73.04 -45.09 59.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.555 -0.293 . . . . 8.8100000000000005 110.468 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -168.56 165.61 12.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.939 0.4 . . . . 7.8200000000000003 110.758 179.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 32.7 mt -101.36 113.52 37.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.883 -0.599 . . . . 7.2199999999999998 109.667 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . 0.51 HG12 ' HG2' ' B' ' 15' ' ' ARG . 64.2 mt -88.72 100.33 10.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.917 -0.583 . . . . 6.7199999999999998 110.005 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' B' ' 92' ' ' SER . 54.0 m -88.38 106.87 18.53 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.106 0.479 . . . . 5.3099999999999996 111.204 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' THR . . . . . 0.613 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 0.4 OUTLIER -81.39 87.03 6.19 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.273 -0.64 . . . . 5.8700000000000001 109.273 178.576 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -69.61 141.47 53.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.692 -0.686 . . . . 6.9000000000000004 110.6 -178.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 2.6 m -149.47 113.53 5.16 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.107 -0.331 . . . . 8.9000000000000004 110.107 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 112' ' ' ASN . . . . . 0.715 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 17.7 t-20 -70.08 133.38 47.11 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.195 0.521 . . . . 11.84 110.987 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . 0.466 HG11 ' HG3' ' B' ' 114' ' ' LYS . 66.2 t -113.6 -51.25 5.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.557 -0.747 . . . . 12.4 109.359 179.138 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . 0.688 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 61.0 mtpt . . . . . 0 C--O 1.246 0.871 0 CA-C-O 118.369 -0.825 . . . . 12.68 109.609 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 56.7 m . . . . . 0 N--CA 1.475 0.784 0 CA-C-O 120.882 0.373 . . . . 15.82 110.432 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -86.13 117.62 69.02 Favored Pre-proline 0 C--N 1.323 -0.553 0 N-CA-C 109.836 -0.431 . . . . 15.44 109.836 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.8 154.49 58.83 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.598 2.198 . . . . 14.109999999999999 112.164 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.824 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.7 OUTLIER -79.92 56.09 2.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.493 0.663 . . . . 11.369999999999999 110.516 179.593 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.504 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 15.6 tt0 -157.12 117.78 3.58 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.058 -0.974 . . . . 10.59 108.939 -178.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.85 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 35.7 p90 -140.77 162.14 36.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.365 0.602 . . . . 9.1999999999999993 112.191 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.44 HG21 HG21 ' A' ' 107' ' ' ILE . 42.8 mm -93.99 124.93 46.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.467 -0.788 . . . . 8.9399999999999995 110.802 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.57 ' HB3' ' HE1' ' A' ' 22' ' ' PHE . 2.4 m -115.14 105.77 13.31 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.27 -0.423 . . . . 6.1100000000000003 110.934 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -89.97 112.58 24.03 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.278 -0.638 . . . . 9.4600000000000009 109.278 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.2 p80 -139.22 159.9 41.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.474 0.178 . . . . 10.369999999999999 110.991 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -77.98 174.9 10.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.443 -0.344 . . . . 13.279999999999999 110.226 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 14.9 pt -57.32 -27.92 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 N-CA-C 113.236 0.828 . . . . 13.970000000000001 113.236 -178.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -80.44 -17.91 50.33 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.107 0.48 . . . . 13.85 111.453 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 110.11 0.1 29.94 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.506 -0.854 . . . . 9.6099999999999994 112.793 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ILE . . . . . 0.48 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 30.9 mm -72.73 118.42 17.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.719 -0.474 . . . . 11.289999999999999 109.719 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.57 ' HE1' ' HB3' ' A' ' 14' ' ' SER . 90.1 m-85 -72.07 124.91 25.96 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.059 0.457 . . . . 10.449999999999999 111.924 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -97.39 -29.2 13.64 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.365 -0.834 . . . . 8.1300000000000008 110.078 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -158.27 125.54 5.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.714 -0.676 . . . . 7.4900000000000002 110.01 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.454 HG21 ' HB2' ' A' ' 40' ' ' LEU . 9.5 t -118.96 134.82 61.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.407 -0.36 . . . . 6.4500000000000002 111.006 -179.376 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.85 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 9.7 t70 -66.26 139.41 58.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.011 -0.54 . . . . 7.3099999999999996 109.771 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -62.77 -14.23 42.51 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.332 0.493 . . . . 12.41 112.332 -179.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 79.7 mtm180 -69.04 -10.97 60.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.675 0.274 . . . . 12.19 111.282 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 27.8 p -60.6 -31.98 71.12 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.765 0.317 . . . . 13.5 110.515 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.559 HG12 HE22 ' A' ' 36' ' ' GLN . 42.5 t -62.04 -35.3 67.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.77 -0.65 . . . . 16.559999999999999 111.296 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -91.25 -8.1 49.35 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.825 0.345 . . . . 15.07 111.69 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.7 ' HA ' HG21 ' A' ' 10' ' ' THR . 24.7 m -97.13 -55.23 2.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.856 0.36 . . . . 15.26 111.322 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 2.9 m -117.18 -13.61 10.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.405 -0.361 . . . . 14.18 111.741 -179.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.426 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 92.11 -15.15 62.67 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.603 -0.808 . . . . 13.85 112.524 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -75.01 139.01 42.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.564 0.221 . . . . 18.59 110.662 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.559 HE22 HG12 ' A' ' 30' ' ' VAL . 33.9 mm-40 -80.59 149.8 68.8 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.394 -0.595 . . . . 15.890000000000001 109.394 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.583 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 51.2 Cg_exo -54.8 -37.41 92.27 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.411 2.074 . . . . 12.26 112.388 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.465 ' HA ' HD12 ' A' ' 41' ' ' LEU . 15.5 mp0 -69.77 -19.07 63.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.125 -0.489 . . . . 13.68 111.347 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.533 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 47.1 mt-10 -82.11 -14.33 55.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.971 0.415 . . . . 17.34 110.37 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.454 ' HB2' HG21 ' A' ' 25' ' ' VAL . 3.2 mm? -101.07 -27.31 13.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.866 -0.606 . . . . 13.56 110.301 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 95.1 mt -60.64 125.54 24.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.947 -0.569 . . . . 13.42 110.673 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 81.54 2.71 90.62 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.872 -0.68 . . . . 13.390000000000001 112.366 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.716 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 9.1 mmpt? -111.69 160.49 17.22 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.776 0.322 . . . . 17.239999999999998 110.647 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.652 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 16.0 m120 -96.48 135.58 38.16 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.041 -0.527 . . . . 12.77 109.698 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.54 HG13 ' HE1' ' A' ' 78' ' ' PHE . 10.6 tt -59.53 -26.09 33.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.18 0.514 . . . . 12.050000000000001 110.947 179.176 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.495 HG12 ' HB3' ' A' ' 44' ' ' ASN . 9.9 p -69.93 -22.18 24.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 115.716 -0.675 . . . . 13.390000000000001 111.424 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.652 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.5 mt-10 -70.05 -36.06 74.72 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.303 0.573 . . . . 16.530000000000001 110.731 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -101.69 34.74 2.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.769 -0.65 . . . . 15.83 110.443 -179.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 36.0 t -120.9 150.25 41.36 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.623 -0.717 . . . . 12.01 110.296 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' HIS . . . . . 0.408 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 7.9 t-160 -58.64 126.23 79.16 Favored Pre-proline 0 C--N 1.329 -0.312 0 N-CA-C 109.147 -0.686 . . . . 15.130000000000001 109.147 178.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -44.51 -48.97 9.61 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 123.348 2.699 . . . . 15.83 114.17 -178.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -73.75 -4.5 34.98 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.36 0.504 . . . . 16.690000000000001 112.36 -179.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.41 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 9.3 m-20 -115.37 -2.13 12.7 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.947 0.403 . . . . 13.16 111.133 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -63.11 -41.0 99.25 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.92 -0.582 . . . . 16.170000000000002 111.156 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.1 tp60 -64.61 -43.33 94.09 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.732 -0.469 . . . . 14.35 109.732 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.8 tp -59.73 -39.34 84.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.756 -0.656 . . . . 12.51 110.139 178.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.46 HD21 ' HA ' ' A' ' 57' ' ' LEU . 0.4 OUTLIER -62.91 -51.31 67.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.842 -0.617 . . . . 10.08 110.402 179.421 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.413 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 62.0 ttt180 -63.25 -43.13 98.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.074 -0.512 . . . . 11.710000000000001 110.756 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.449 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 33.6 t70 -59.02 -47.98 83.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.273 -0.421 . . . . 9.7100000000000009 110.475 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.6 m -62.63 -34.96 78.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.967 -0.56 . . . . 9.5199999999999996 110.524 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.593 ' O ' HG12 ' A' ' 64' ' ' VAL . 3.5 m-30 -63.96 -42.18 97.35 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.872 -0.418 . . . . 12.109999999999999 109.872 178.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 58' ' ' ARG . 18.0 mm100 -67.98 -32.73 73.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.305 -0.407 . . . . 10.289999999999999 110.12 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.449 ' HG3' ' O ' ' A' ' 59' ' ' ASP . 39.2 mt-30 -70.73 -38.52 73.58 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.095 -0.502 . . . . 10.619999999999999 111.035 179.647 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.593 HG12 ' O ' ' A' ' 61' ' ' PHE . 2.7 p -67.42 -25.84 34.38 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 CA-C-O 120.857 0.36 . . . . 10.93 110.519 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 61' ' ' PHE . 89.7 t -74.94 -21.81 16.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 N-CA-C 108.89 -0.782 . . . . 12.890000000000001 108.89 178.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.7 mtpt -86.07 -32.62 21.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.393 -0.821 . . . . 16.68 109.489 178.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.806 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 82.0 mt -69.06 -54.87 12.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.586 -0.733 . . . . 13.18 110.538 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 95.1 mttt 59.67 97.59 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.977 0.798 . . . . 15.17 112.325 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.28 -12.38 68.11 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.647 -0.787 . . . . 10.01 112.235 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.806 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 6.7 tp-100 -99.2 137.22 38.02 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.322 -0.621 . . . . 10.039999999999999 109.322 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . 0.464 ' HB ' ' HZ ' ' B' ' 24' ' ' PHE . 3.9 p -88.88 121.93 39.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.3 0.572 . . . . 8.5399999999999991 110.792 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 41.0 tp -109.45 115.49 30.05 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.699 -0.682 . . . . 8.1300000000000008 109.734 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.3 m -92.46 104.17 16.52 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.113 -0.494 . . . . 7.8899999999999997 111.031 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.46 HG12 ' HB ' ' A' ' 90' ' ' THR . 2.4 p -96.98 125.29 50.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.017 -0.538 . . . . 8.1799999999999997 109.803 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 18.5 ttt -100.98 115.43 30.46 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.995 0.426 . . . . 9.6999999999999993 111.025 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.41 ' HB2' ' HB3' ' A' ' 53' ' ' ASP . 40.6 p90 -146.28 -172.69 4.0 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.478 -0.783 . . . . 10.27 109.116 179.367 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.632 ' HB3' ' HB3' ' A' ' 85' ' ' TRP . 55.9 mtm180 -108.97 118.27 36.36 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.164 0.507 . . . . 13.859999999999999 110.833 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.54 ' HE1' HG13 ' A' ' 45' ' ' ILE . 18.2 t80 -96.71 149.63 21.59 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.4 -0.818 . . . . 9.7300000000000004 110.407 -179.18 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.606 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 17.1 ttt180 -87.0 121.56 29.64 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.163 -0.471 . . . . 11.300000000000001 111.133 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.45 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 60.4 p -88.25 178.63 6.55 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.156 -0.474 . . . . 11.039999999999999 110.201 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -70.62 -13.53 62.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.272 0.558 . . . . 13.18 109.934 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -89.97 2.56 54.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.532 -0.758 . . . . 14.890000000000001 109.624 179.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 67.34 31.98 6.16 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.415 -0.811 . . . . 12.92 111.046 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.511 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 4.1 pt-20 -108.09 171.47 7.39 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.326 -0.62 . . . . 10.94 109.326 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' TRP . . . . . 0.632 ' HB3' ' HB3' ' A' ' 77' ' ' ARG . 23.7 m95 -120.41 98.57 6.11 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.079 -0.341 . . . . 11.77 110.079 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.418 ' O ' ' HA ' ' A' ' 77' ' ' ARG . 1.1 pp -96.8 151.93 19.17 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.334 -0.393 . . . . 11.57 110.886 -179.435 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.538 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 95.5 m95 -73.93 116.54 14.67 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.257 0.551 . . . . 10.73 110.66 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 36.2 tpp -116.54 131.76 56.86 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.397 -0.82 . . . . 9.7400000000000002 110.79 -179.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.2 ttp180 -100.87 70.14 1.37 Allowed 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.326 -0.99 . . . . 11.16 108.326 178.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.46 ' HB ' HG12 ' A' ' 74' ' ' VAL . 41.7 m -60.78 107.34 0.68 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.58 -0.736 . . . . 9.5899999999999999 112.27 -178.328 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' SER . . . . . 0.504 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 0.7 OUTLIER -86.52 88.92 7.74 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.11 -0.95 . . . . 8.8800000000000008 109.719 179.407 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 18.7 m -77.92 126.43 30.83 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.135 -0.484 . . . . 8.9399999999999995 111.369 -179.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -131.12 117.23 18.79 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.864 -0.607 . . . . 12.1 109.887 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.93 118.73 16.23 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.298 -0.41 . . . . 10.16 110.729 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -91.86 119.8 31.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.018 0.437 . . . . 12.6 110.619 -179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.46 ' HG2' HG12 ' A' ' 103' ' ' ILE . 34.0 mt-30 -124.15 167.51 14.16 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.75 -0.659 . . . . 14.6 110.003 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.423 ' C ' ' H ' ' A' ' 99' ' ' TYR . 64.1 m-80 -115.89 172.87 3.36 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 109.381 -0.6 . . . . 13.83 109.381 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . 0.414 ' CD ' ' HB3' ' A' ' 97' ' ' ASN . 6.8 Cg_exo -75.69 28.87 0.38 Allowed 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.522 2.148 . . . . 15.34 112.308 178.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . 0.423 ' H ' ' C ' ' A' ' 97' ' ' ASN . 62.4 m-85 -92.87 -160.6 0.76 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.325 -0.398 . . . . 16.890000000000001 110.818 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.409 ' H ' ' HB3' ' A' ' 99' ' ' TYR . 1.2 m -83.26 65.19 8.15 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.613 0.598 . . . . 15.140000000000001 112.613 -178.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 41.0 t0 51.01 76.18 0.17 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.646 -0.707 . . . . 14.94 112.45 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.31 165.57 20.29 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.844 -0.617 . . . . 12.949999999999999 109.884 179.138 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.46 HG12 ' HG2' ' A' ' 96' ' ' GLN . 80.1 mt -136.86 120.83 23.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 110.218 -0.289 . . . . 11.44 110.218 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -81.16 -44.55 17.71 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.614 -0.434 . . . . 11.65 110.469 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -165.46 178.18 6.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.481 -0.327 . . . . 10.35 110.52 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 40.8 mt -115.57 122.95 70.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.078 -0.51 . . . . 10.470000000000001 110.224 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.654 HG23 HH22 ' B' ' 15' ' ' ARG . 61.8 mt -93.21 114.84 30.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.13 -0.486 . . . . 9.3200000000000003 109.863 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 79.5 m -108.77 119.47 39.62 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.119 0.485 . . . . 10.15 111.423 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.504 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 2.6 m -88.16 101.01 13.4 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.643 -0.873 . . . . 11.4 108.643 178.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . 0.504 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 42.6 m-20 -79.23 104.32 9.77 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.232 -0.44 . . . . 11.640000000000001 111.547 -178.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 5.6 m -104.18 118.83 37.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.623 -0.717 . . . . 11.220000000000001 110.515 179.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . 0.824 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 3.5 t-20 -80.82 117.9 21.87 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.015 0.435 . . . . 12.98 110.299 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 18.9 t -97.77 -54.62 6.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.864 -0.607 . . . . 15.109999999999999 109.776 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.538 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 48.9 mtpt . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.224 -0.893 . . . . 16.32 109.52 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 71.5 m . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 110.108 -0.33 . . . . 7.8399999999999999 110.108 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' GLN . . . . . 0.93 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 93.0 mm-40 -112.85 150.42 42.79 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 116.529 -0.305 . . . . 7.4900000000000002 110.828 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.2 174.32 12.67 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 123.015 2.476 . . . . 6.4400000000000004 113.131 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' THR . . . . . 0.487 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.0 OUTLIER -83.56 58.51 4.61 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 116.001 -0.545 . . . . 5.9800000000000004 111.536 -179.86 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . 0.592 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 7.7 pt-20 -166.42 136.42 3.24 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.173 -0.677 . . . . 5.8499999999999996 109.173 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 39.6 p90 -146.12 156.61 43.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.331 0.586 . . . . 6.4900000000000002 112.005 -179.047 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . 0.482 HG22 ' HG3' ' B' ' 15' ' ' ARG . 28.0 mm -86.08 119.13 33.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.359 -0.837 . . . . 6.0199999999999996 110.264 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.781 ' HB3' ' HE2' ' B' ' 22' ' ' PHE . 1.2 m -107.13 92.12 3.95 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.963 -0.562 . . . . 5.3700000000000001 110.507 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' ARG . . . . . 0.654 HH22 HG23 ' A' ' 107' ' ' ILE . 8.5 mtp180 -85.3 102.06 13.06 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.308 -0.627 . . . . 9.4600000000000009 109.308 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 29.9 p80 -131.43 164.07 26.54 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.236 -0.438 . . . . 8.3100000000000005 110.872 -179.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -78.2 179.18 7.05 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.318 -0.401 . . . . 11.19 110.621 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 27.3 pt -56.88 -33.32 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 113.252 0.834 . . . . 9.3699999999999992 113.252 -178.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -76.13 -21.94 56.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.088 0.471 . . . . 11.92 111.382 -179.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 114.05 -4.19 23.97 Favored Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 120.665 -0.779 . . . . 8.6799999999999997 112.327 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' ILE . . . . . 0.424 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 38.7 mm -67.15 114.26 3.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.939 -0.393 . . . . 11.16 109.939 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' PHE . . . . . 0.781 ' HE2' ' HB3' ' B' ' 14' ' ' SER . 97.3 m-85 -68.48 126.32 29.27 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.168 -0.469 . . . . 8.5999999999999996 111.242 -179.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 3.9 m -100.01 -37.88 8.81 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.61 -0.723 . . . . 7.9100000000000001 110.171 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . 0.474 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 30.1 t80 -147.77 123.41 10.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.675 -0.693 . . . . 8.5 109.496 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' VAL . . . . . 0.524 HG21 ' HB2' ' B' ' 40' ' ' LEU . 14.5 t -120.46 138.87 49.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 120.884 0.374 . . . . 6.5 111.074 -179.005 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -71.15 153.55 42.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.852 -0.613 . . . . 7.1500000000000004 109.971 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 34.9 m170 -70.16 -10.82 60.0 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.806 0.299 . . . . 9.4100000000000001 111.806 -178.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . 0.93 ' HG2' ' HB3' ' B' ' 8' ' ' GLN . 72.7 mtm180 -68.08 -11.45 59.07 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 111.995 0.368 . . . . 9.7599999999999998 111.995 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 20.2 p -58.32 -38.76 77.77 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 111.861 0.319 . . . . 11.56 111.861 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 4.1 t -66.39 -31.96 55.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.338 -0.392 . . . . 14.01 111.072 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.63 -10.82 56.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.904 0.383 . . . . 12.9 111.458 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' THR . . . . . 0.429 ' HA ' HG21 ' B' ' 10' ' ' THR . 14.8 m -99.74 -59.83 1.64 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.068 -0.515 . . . . 12.34 111.978 -179.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' VAL . . . . . 0.712 HG12 HD21 ' B' ' 86' ' ' LEU . 3.3 m -116.57 -5.48 11.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 111.824 0.305 . . . . 13.869999999999999 111.824 -179.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.22 0.94 89.61 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.651 -0.785 . . . . 14.369999999999999 112.285 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -80.1 137.0 36.66 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.644 0.259 . . . . 15.56 111.054 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . 0.559 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 75.8 mm-40 -79.4 150.01 73.03 Favored Pre-proline 0 C--N 1.322 -0.63 0 N-CA-C 108.667 -0.864 . . . . 13.859999999999999 108.667 178.256 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . 0.517 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 51.6 Cg_exo -53.18 -38.5 81.26 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.613 2.208 . . . . 15.210000000000001 112.303 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -67.79 -22.2 65.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.965 -0.561 . . . . 17.82 111.408 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' GLU . . . . . 0.559 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 36.4 mt-10 -73.82 -23.12 59.62 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.655 0.264 . . . . 14.42 110.951 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.524 ' HB2' HG21 ' B' ' 25' ' ' VAL . 1.7 mm? -93.17 -34.92 13.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.895 0.379 . . . . 14.550000000000001 110.625 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 81.7 mt -58.31 119.07 6.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 14.050000000000001 111.259 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.33 5.01 76.55 Favored Glycine 0 N--CA 1.454 -0.163 0 C-N-CA 121.002 -0.618 . . . . 11.68 112.636 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.45 ' HA ' ' NZ ' ' B' ' 43' ' ' LYS . 0.5 OUTLIER -119.04 159.53 23.71 Favored 'General case' 0 C--N 1.321 -0.664 0 O-C-N 122.586 -0.361 . . . . 14.17 110.353 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' ASN . . . . . 0.652 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 12.5 m120 -95.46 140.15 30.73 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.35 -0.611 . . . . 10.74 109.35 178.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 20.8 tt -61.28 -24.63 33.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.305 0.574 . . . . 9.8800000000000008 110.542 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 9.0 p -71.84 -22.68 21.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.774 -0.648 . . . . 11.779999999999999 111.183 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' GLU . . . . . 0.652 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 40.5 mt-10 -67.07 -34.6 78.0 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.164 0.507 . . . . 11.890000000000001 110.481 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -104.08 24.67 11.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.729 -0.669 . . . . 14.279999999999999 110.433 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 49.0 t -109.19 148.78 30.38 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.832 -0.622 . . . . 10.81 110.41 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 8.1 t-160 -64.9 126.72 91.69 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.713 -0.676 . . . . 12.029999999999999 109.236 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -43.24 -48.8 7.81 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 123.534 2.823 . . . . 11.869999999999999 113.779 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -70.53 -7.91 47.34 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.135 0.42 . . . . 9.2799999999999994 112.135 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' ASP . . . . . 0.599 ' HB3' ' HB2' ' B' ' 76' ' ' PHE . 16.5 m-20 -117.57 -1.17 11.71 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.951 0.405 . . . . 7.5199999999999996 110.706 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -65.14 -49.22 70.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.969 -0.559 . . . . 6.5700000000000003 111.659 -178.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -64.96 -34.86 79.43 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.504 -0.554 . . . . 6.9900000000000002 109.504 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.3 tp -58.09 -42.92 86.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.961 -0.563 . . . . 5.1399999999999997 109.777 178.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' LEU . . . . . 0.431 HD21 ' HA ' ' B' ' 57' ' ' LEU . 0.9 OUTLIER -69.16 -48.95 60.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.94 -0.573 . . . . 6.8200000000000003 110.265 179.007 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 28.5 ttt180 -57.45 -46.32 83.75 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.875 -0.602 . . . . 8.6899999999999995 111.244 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -61.0 -41.21 96.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.227 -0.442 . . . . 6.46 110.744 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 44.6 m -64.15 -35.54 81.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.479 . . . . 5.5899999999999999 110.486 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' PHE . . . . . 0.522 ' O ' HG12 ' B' ' 64' ' ' VAL . 9.7 m-85 -64.18 -40.85 96.97 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.475 -0.565 . . . . 8.3300000000000001 109.475 178.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -63.15 -38.83 92.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.96 -0.564 . . . . 7.1500000000000004 109.969 178.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' GLN . . . . . 0.501 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 68.6 mt-30 -67.14 -47.62 70.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.688 -0.687 . . . . 9.5299999999999994 111.132 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' VAL . . . . . 0.522 HG12 ' O ' ' B' ' 61' ' ' PHE . 4.1 p -62.24 -30.99 50.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-N 116.387 -0.37 . . . . 8.2200000000000006 111.864 -178.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . 0.444 HG23 ' O ' ' B' ' 61' ' ' PHE . 70.9 t -68.75 -37.65 77.78 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 109.516 -0.55 . . . . 7.4299999999999997 109.516 178.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -71.57 -32.72 68.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.786 -0.643 . . . . 10.52 110.165 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' B' ' 63' ' ' GLN . 94.0 mt -67.33 -54.13 23.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.854 -0.612 . . . . 7.5300000000000002 110.365 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 23.5 mttt 63.26 113.37 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.439 -0.8 . . . . 8.0099999999999998 112.008 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 77.26 19.81 76.23 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.798 -0.715 . . . . 5.8700000000000001 112.17 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -126.01 153.5 44.3 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.937 -0.394 . . . . 5.6299999999999999 109.937 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' VAL . . . . . 0.504 ' CG2' ' HB3' ' B' ' 91' ' ' SER . 3.3 p -110.96 116.37 52.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-O 121.299 0.571 . . . . 6.0599999999999996 110.518 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 18.7 tp -107.95 116.56 32.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.701 -0.681 . . . . 4.9299999999999997 110.306 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' SER . . . . . 0.555 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 7.6 m -90.36 115.7 27.75 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.175 -0.466 . . . . 6.79 110.995 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 p -113.83 126.96 71.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 116.096 -0.502 . . . . 4.4199999999999999 110.107 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 24.7 ttt -94.83 113.79 25.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.167 0.508 . . . . 5.6699999999999999 110.563 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.599 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 48.0 p90 -137.9 -174.58 3.82 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.63 -0.714 . . . . 3.75 109.397 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' ARG . . . . . . . . . . . . . 9.3 mtm180 -108.3 115.19 29.66 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.99 0.424 . . . . 7.3499999999999996 110.11 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . 0.54 ' HD2' HG13 ' B' ' 33' ' ' VAL . 28.0 t80 -100.52 148.46 24.77 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.656 -0.702 . . . . 5.79 110.282 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' ARG . . . . . 0.523 ' HA ' ' O ' ' B' ' 84' ' ' GLU . 20.2 ttp180 -85.77 133.47 33.99 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.142 -0.481 . . . . 11.529999999999999 110.725 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' SER . . . . . 0.457 ' HA ' ' HB ' ' B' ' 33' ' ' VAL . 96.6 p -93.14 179.48 5.41 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.522 -0.547 . . . . 7.4699999999999998 109.522 178.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 47.3 tptt -67.89 -14.76 63.22 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.607 0.718 . . . . 12.67 109.53 178.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 40.0 m-20 -89.02 2.52 53.89 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.151 -0.931 . . . . 9.25 109.685 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 66.49 25.08 10.22 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 115.305 -0.862 . . . . 8.75 111.522 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . 0.523 ' O ' ' HA ' ' B' ' 79' ' ' ARG . 1.9 pt-20 -104.29 167.15 9.94 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.228 -0.656 . . . . 6.8700000000000001 109.228 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' TRP . . . . . 0.519 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 49.3 m95 -109.04 118.82 37.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.049 0.452 . . . . 8.3800000000000008 110.69 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' LEU . . . . . 0.712 HD21 HG12 ' B' ' 33' ' ' VAL . 2.1 pp -116.02 150.38 37.33 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.004 -0.544 . . . . 7.25 109.986 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 87' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -72.73 122.19 21.09 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.871 -0.418 . . . . 9.3000000000000007 109.871 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 15.0 tpp -128.35 126.6 41.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.135 -0.484 . . . . 4.46 110.96 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 30.3 ttp180 -100.19 87.58 3.49 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.292 -1.003 . . . . 7.3099999999999996 108.292 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 90' ' ' THR . . . . . 0.452 HG22 ' HB3' ' B' ' 108' ' ' CYS . 28.0 m -80.66 112.87 18.42 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.672 -0.694 . . . . 6.1799999999999997 112.309 -178.305 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 91' ' ' SER . . . . . 0.665 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 44.5 m -88.76 90.67 8.51 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.584 -0.734 . . . . 6.4500000000000002 109.179 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 92' ' ' SER . . . . . 0.532 ' HA ' ' HA ' ' B' ' 108' ' ' CYS . 15.6 m -78.77 122.37 25.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.235 -0.438 . . . . 6.75 111.502 -178.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -118.17 121.37 40.33 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.284 -0.417 . . . . 6.4500000000000002 110.562 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 94' ' ' THR . . . . . 0.413 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.6 OUTLIER -86.19 100.72 12.43 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.426 -0.352 . . . . 9.8800000000000008 110.189 179.051 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -76.71 126.28 30.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.988 0.423 . . . . 8.9100000000000001 111.084 -179.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -94.84 116.33 28.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.867 -0.606 . . . . 10.99 109.731 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 97' ' ' ASN . . . . . 0.4 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 51.5 t30 -65.46 126.75 92.11 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 109.544 -0.539 . . . . 8.5099999999999998 109.544 179.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 98' ' ' PRO . . . . . 0.4 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 58.2 Cg_endo -71.29 42.72 0.46 Allowed 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 123.076 2.518 . . . . 9.1600000000000001 113.693 -178.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -118.56 -61.2 1.69 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.407 -0.59 . . . . 11.390000000000001 109.407 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -135.14 22.47 3.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.638 -0.71 . . . . 7.9000000000000004 109.868 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 4.3 t70 63.42 24.59 14.21 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.549 -0.75 . . . . 9.0800000000000001 110.727 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -84.93 143.03 29.25 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.995 0.426 . . . . 7.71 110.462 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 67.1 mt -79.72 109.43 14.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.295 -0.412 . . . . 8.3800000000000008 109.896 179.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -71.6 -41.93 68.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.422 -0.353 . . . . 8.8100000000000005 110.647 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -169.89 168.63 8.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.296 -0.411 . . . . 7.8200000000000003 109.911 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 22.1 mt -103.21 118.89 50.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.106 -0.497 . . . . 7.2199999999999998 110.036 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 46.3 mt -88.62 93.19 4.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.74 -0.664 . . . . 6.7199999999999998 109.912 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' CYS . . . . . 0.532 ' HA ' ' HA ' ' B' ' 92' ' ' SER . 67.1 m -87.75 116.79 26.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.183 -0.462 . . . . 5.3099999999999996 111.295 -179.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' THR . . . . . 0.665 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 1.2 m -88.69 83.38 6.73 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.149 -0.686 . . . . 5.8700000000000001 109.149 178.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' ASN . . . . . 0.502 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 6.1 m-20 -67.24 103.08 1.16 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.707 -0.679 . . . . 6.9000000000000004 111.14 -178.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 1.1 m -110.85 114.39 27.7 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.415 -0.357 . . . . 8.9000000000000004 110.332 179.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 112' ' ' ASN . . . . . 0.495 HD21 HD11 ' B' ' 86' ' ' LEU . 4.6 t-20 -68.65 135.32 51.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.02 0.438 . . . . 11.84 110.772 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 9.4 t -104.29 -59.06 3.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.868 -0.606 . . . . 12.4 109.627 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 24.3 mtpt . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.207 -0.902 . . . . 12.68 109.945 -179.858 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.554 ' HA ' HG11 ' B' ' 71' ' ' VAL . 16.5 mt-30 . . . . . 0 C--O 1.235 0.306 0 CA-C-O 120.647 0.26 . . . . 15.08 110.728 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -72.87 159.8 47.44 Favored 'Trans proline' 0 C--O 1.234 0.292 0 C-N-CA 122.859 2.373 . . . . 13.43 112.013 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.511 HG22 HG23 ' A' ' 32' ' ' THR . 0.1 OUTLIER -83.14 52.04 2.1 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.333 0.587 . . . . 11.09 111.106 179.92 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.667 ' HB2' HG23 ' A' ' 111' ' ' THR . 37.6 tt0 -147.09 136.93 23.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.446 -0.797 . . . . 10.59 108.964 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.84 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 42.5 p90 -151.75 154.16 35.72 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.071 0.463 . . . . 8.93 111.489 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.432 HD13 ' HA ' ' A' ' 13' ' ' ILE . 21.1 mm -88.64 127.31 41.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.061 -0.518 . . . . 8.66 110.842 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.901 ' HB3' ' HE2' ' A' ' 22' ' ' PHE . 1.4 m -110.23 97.39 6.88 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.831 -0.622 . . . . 6.11 110.791 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 11.2 mtt180 -86.24 110.43 19.61 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.545 -0.539 . . . . 9.09 109.545 179.342 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 33.3 p80 -147.03 156.2 42.83 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.629 -0.259 . . . . 9.79 110.558 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -76.62 -175.68 3.46 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.628 0.252 . . . . 12.69 110.926 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 26.9 pt -62.31 -25.44 37.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 N-CA-C 112.873 0.694 . . . . 13.58 112.873 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -76.5 -30.53 57.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.214 0.53 . . . . 13.85 110.669 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 118.02 -6.38 15.4 Favored Glycine 0 N--CA 1.444 -0.814 0 N-CA-C 111.225 -0.75 . . . . 9.38 111.225 -179.371 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.444 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 34.6 mm -68.69 117.84 11.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 O-C-N 123.973 0.455 . . . . 10.74 109.791 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.901 ' HE2' ' HB3' ' A' ' 14' ' ' SER . 87.7 m-85 -73.2 132.92 43.78 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.083 0.468 . . . . 9.73 112.081 -178.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.02 -27.37 12.17 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.3 -0.864 . . . . 7.74 110.278 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.434 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 31.2 t80 -154.33 121.63 5.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.701 -0.681 . . . . 6.92 109.516 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.611 ' HB ' ' HB3' ' A' ' 37' ' ' PRO . 4.8 t -110.39 146.36 15.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.033 0.444 . . . . 6.02 111.236 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.84 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 6.0 t70 -68.5 170.89 8.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.546 -0.752 . . . . 7.31 110.459 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -94.27 -21.43 19.02 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.11 0.481 . . . . 11.67 110.077 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 77.0 mtm180 -78.92 0.1 28.73 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.866 -0.606 . . . . 11.91 111.89 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 28.2 p -64.96 -33.51 76.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.972 0.415 . . . . 12.99 110.641 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.502 ' O ' ' HA2' ' A' ' 34' ' ' GLY . 2.9 t -69.59 -27.08 32.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.933 -0.576 . . . . 16.15 110.726 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.92 -24.38 26.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.105 0.479 . . . . 15.07 110.278 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.511 HG23 HG22 ' A' ' 10' ' ' THR . 25.2 m -85.01 -61.92 1.66 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.753 -0.658 . . . . 14.9 111.699 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.612 HG23 ' H ' ' A' ' 35' ' ' TYR . 15.6 m -111.35 -15.22 10.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 111.941 0.349 . . . . 13.84 111.941 -179.245 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.502 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 89.39 0.11 80.19 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.423 -0.894 . . . . 13.85 112.325 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.612 ' H ' HG23 ' A' ' 33' ' ' VAL . 0.7 OUTLIER -83.46 135.04 34.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.653 0.263 . . . . 18.28 110.458 179.882 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.669 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 79.0 mm-40 -75.41 146.71 81.49 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 116.054 -0.521 . . . . 15.48 110.059 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.611 ' HB3' ' HB ' ' A' ' 25' ' ' VAL . 41.6 Cg_exo -57.12 -35.35 98.89 Favored 'Trans proline' 0 CA--C 1.527 0.166 0 C-N-CA 122.588 2.192 . . . . 11.63 112.185 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.436 ' HA ' HD12 ' A' ' 41' ' ' LEU . 22.4 mp0 -69.25 -15.93 63.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.96 -0.564 . . . . 13.31 111.493 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.669 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 34.8 mt-10 -81.09 -32.48 33.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.786 0.327 . . . . 17.34 111.013 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.565 ' HB2' HG21 ' A' ' 25' ' ' VAL . 2.9 mm? -82.1 -24.66 35.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.121 -0.49 . . . . 13.25 110.915 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 89.7 mt -62.69 116.69 5.42 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.136 -0.484 . . . . 12.99 111.402 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.32 -4.26 85.34 Favored Glycine 0 N--CA 1.451 -0.339 0 CA-C-N 115.879 -0.601 . . . . 13.39 112.694 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.466 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 6.1 mmpt? -107.87 161.91 14.49 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.617 0.246 . . . . 16.87 110.457 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.762 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 15.1 m120 -95.66 139.02 32.51 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.544 -0.539 . . . . 12.5 109.544 179.094 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.58 HG13 ' HE1' ' A' ' 78' ' ' PHE . 9.1 tt -61.85 -30.37 48.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.016 0.436 . . . . 11.72 110.589 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.0 p -65.7 -22.03 30.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 116.183 -0.462 . . . . 12.89 111.254 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.762 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 41.1 mt-10 -73.83 -17.73 61.03 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.358 -0.383 . . . . 16.53 111.553 -179.304 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -117.97 24.53 10.96 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.17 0.51 . . . . 15.34 110.198 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 48.9 t -112.08 155.73 23.38 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.665 -0.698 . . . . 11.97 110.305 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.59 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 4.9 t-160 -56.92 122.33 51.93 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.842 -0.617 . . . . 14.67 109.408 178.738 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 99.2 Cg_exo -45.29 -49.06 10.7 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.456 2.77 . . . . 15.15 114.157 -178.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -75.77 0.93 16.22 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.291 0.478 . . . . 16.47 112.291 -179.136 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.59 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 26.4 m-20 -124.96 7.78 8.03 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.162 0.506 . . . . 13.16 110.159 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -66.35 -44.1 84.17 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.79 -0.641 . . . . 15.83 110.592 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.7 tp60 -62.58 -38.36 89.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.302 -0.408 . . . . 13.94 109.925 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.9 tp -57.48 -40.12 77.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.89 -0.595 . . . . 12.11 110.182 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.417 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.9 OUTLIER -69.59 -49.03 58.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.793 -0.639 . . . . 9.71 110.155 179.348 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.426 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 70.6 ttt180 -58.61 -48.61 80.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.986 -0.552 . . . . 11.06 111.392 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -56.56 -44.98 81.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.039 0.447 . . . . 9.71 110.807 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.3 m -70.28 -31.36 68.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.017 -0.538 . . . . 9.52 110.994 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.56 ' O ' HG12 ' A' ' 64' ' ' VAL . 1.4 m-30 -65.12 -49.99 67.79 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.048 -0.353 . . . . 11.4 110.048 178.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 58' ' ' ARG . 65.9 mm-40 -64.8 -29.9 70.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.337 0.589 . . . . 10.04 109.572 179.252 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -66.27 -48.56 70.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.014 -0.993 . . . . 10.6 110.648 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.56 HG12 ' O ' ' A' ' 61' ' ' PHE . 4.3 p -64.74 -25.1 37.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-O 120.838 0.351 . . . . 10.62 110.87 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.615 ' HA ' HG21 ' A' ' 94' ' ' THR . 93.1 t -70.61 -40.39 77.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 108.954 -0.758 . . . . 12.41 108.954 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -72.97 -29.24 62.91 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.546 -0.752 . . . . 16.25 109.963 178.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.737 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 88.7 mt -70.13 -48.17 58.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.981 -0.554 . . . . 12.66 109.94 178.644 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 32.8 mttt 59.61 99.47 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.571 -0.741 . . . . 14.83 112.607 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.03 -26.27 13.75 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.674 -0.774 . . . . 9.8 112.886 178.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.737 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 46.4 tp60 -79.11 113.12 16.98 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.744 0.307 . . . . 9.59 110.251 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 3.0 p -66.64 116.6 6.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.804 -0.634 . . . . 8.1 110.805 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 64.8 tp -111.88 108.15 17.42 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.696 -0.684 . . . . 7.8 110.381 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.561 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 1.2 m -87.45 109.33 19.51 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.961 -0.563 . . . . 7.59 110.95 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.8 p -102.34 132.93 47.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.766 -0.457 . . . . 7.84 109.766 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' MET . . . . . 0.479 ' HG2' ' HE3' ' A' ' 87' ' ' TRP . 23.1 ttt -102.41 122.0 43.44 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.904 0.383 . . . . 9.35 111.07 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.518 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 47.8 p90 -148.89 -174.7 4.7 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.204 -0.453 . . . . 9.66 110.075 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.49 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 31.2 mtm180 -110.61 120.65 43.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.12 0.486 . . . . 13.1 110.297 178.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.58 ' HE1' HG13 ' A' ' 45' ' ' ILE . 15.9 t80 -101.0 153.51 19.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.311 -0.859 . . . . 9.28 110.143 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.53 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 42.7 ttt180 -90.01 124.0 34.38 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.13 -0.486 . . . . 10.87 110.636 179.596 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.42 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 59.5 p -85.84 -179.43 6.82 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.22 -0.446 . . . . 10.77 110.469 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -71.16 -14.45 62.28 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.516 0.674 . . . . 12.66 109.476 179.003 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.456 ' O ' ' HB2' ' A' ' 83' ' ' GLN . 87.9 m-20 -88.77 -1.79 58.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.435 -0.802 . . . . 14.42 109.74 179.031 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' A' ' 82' ' ' ASN . 2.9 mp0 72.54 22.62 3.28 Favored 'General case' 0 N--CA 1.465 0.277 0 O-C-N 123.902 0.751 . . . . 12.69 110.748 -179.239 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.482 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.0 pt-20 -97.68 170.41 9.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.823 -0.626 . . . . 10.85 109.515 179.264 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.53 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 51.5 m95 -116.72 110.75 18.85 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.86 0.362 . . . . 11.2 110.529 -179.572 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.49 ' O ' ' HA ' ' A' ' 77' ' ' ARG . 0.5 OUTLIER -108.74 150.17 27.98 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.09 -0.504 . . . . 11.12 110.581 -179.821 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.904 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 72.0 m95 -82.35 117.12 22.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.972 0.415 . . . . 10.28 110.394 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.419 ' SD ' ' HB3' ' A' ' 110' ' ' ASN . 9.2 ttp -126.04 138.59 53.73 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.055 -0.52 . . . . 9.32 110.602 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 33.1 ttp-105 -103.81 107.38 18.23 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.896 -0.779 . . . . 10.66 108.896 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.629 HG23 ' HB3' ' A' ' 108' ' ' CYS . 24.7 m -92.61 105.37 17.54 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.742 -0.663 . . . . 9.37 112.426 -178.401 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.784 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 64.0 m -82.28 87.21 6.57 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.525 -0.917 . . . . 8.27 108.525 177.627 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.493 ' HA ' ' HA ' ' A' ' 108' ' ' CYS . 32.8 m -74.98 125.23 28.46 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.059 -0.519 . . . . 8.65 111.739 -178.625 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -123.41 109.52 13.97 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.593 -0.73 . . . . 11.56 109.58 179.047 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.615 HG21 ' HA ' ' A' ' 65' ' ' VAL . 0.2 OUTLIER -72.11 123.41 22.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.424 -0.353 . . . . 10.16 110.483 179.922 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 95' ' ' PHE . . . . . 0.442 ' O ' ' HA ' ' A' ' 103' ' ' ILE . 23.0 t80 -92.48 113.21 25.43 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.929 0.395 . . . . 12.25 111.09 -179.024 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -92.62 132.21 37.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.855 -0.611 . . . . 14.24 110.487 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -85.29 138.62 36.4 Favored Pre-proline 0 C--N 1.319 -0.751 0 N-CA-C 109.752 -0.462 . . . . 13.83 109.752 178.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -64.2 -11.45 27.84 Favored 'Trans proline' 0 CA--C 1.531 0.362 0 C-N-CA 122.753 2.302 . . . . 15.34 114.053 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -62.98 -74.7 0.09 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.741 0.305 . . . . 16.89 110.998 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.3 m -127.08 24.52 6.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.579 -0.282 . . . . 14.89 110.966 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 28.7 t70 62.64 35.52 14.19 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.445 0.641 . . . . 14.77 110.615 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.1 139.47 30.94 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.406 -0.361 . . . . 12.95 110.382 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.442 ' HA ' ' O ' ' A' ' 95' ' ' PHE . 50.5 mt -83.32 106.97 14.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.209 -0.45 . . . . 11.11 109.967 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -73.2 -38.96 65.93 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.882 -0.327 . . . . 11.65 110.661 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.458 ' HE1' HG12 ' A' ' 107' ' ' ILE . 16.3 p90 -159.8 167.98 26.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.378 -0.374 . . . . 10.3 110.291 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 21.4 mt -110.18 120.63 61.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.969 -0.56 . . . . 10.29 110.138 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.606 HG21 HH22 ' B' ' 15' ' ' ARG . 15.7 mt -88.54 95.92 5.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.098 -0.501 . . . . 8.99 109.657 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.629 ' HB3' HG23 ' A' ' 90' ' ' THR . 96.3 m -91.07 116.32 28.7 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.086 -0.507 . . . . 9.83 111.936 -178.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.784 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 2.8 m -86.97 97.55 10.76 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.798 -0.815 . . . . 10.84 108.798 178.286 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.441 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 8.5 m-20 -86.14 104.82 16.07 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.143 -0.481 . . . . 11.26 111.908 -177.805 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.667 HG23 ' HB2' ' A' ' 11' ' ' GLU . 1.9 m -112.15 120.05 40.48 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.751 -0.462 . . . . 11.22 109.751 178.374 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ASN . . . . . 0.482 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 2.1 t30 -72.13 129.57 38.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.182 0.515 . . . . 12.78 111.072 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 3.5 t -103.45 -46.36 10.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.543 -0.753 . . . . 14.64 110.058 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.904 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 51.8 mtpt . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.44 -0.79 . . . . 16.02 109.74 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 56.1 m . . . . . 0 N--CA 1.479 1.02 0 CA-C-O 120.989 0.423 . . . . 7.49 110.373 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 8' ' ' GLN . . . . . 0.83 ' HG3' ' HA ' ' B' ' 28' ' ' ARG . 1.7 pm0 -108.15 150.6 40.67 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.234 -0.439 . . . . 7.12 109.887 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 9' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' B' ' 8' ' ' GLN . 11.3 Cg_exo -72.32 176.23 8.9 Favored 'Trans proline' 0 C--O 1.234 0.287 0 C-N-CA 122.842 2.361 . . . . 6.18 112.23 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 10' ' ' THR . . . . . 0.746 HG22 ' HA ' ' B' ' 32' ' ' THR . 0.1 OUTLIER -82.59 50.5 1.67 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.272 -0.422 . . . . 5.81 111.684 -179.718 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.591 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -148.28 139.71 23.53 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.608 -0.515 . . . . 5.85 109.608 179.709 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 12' ' ' PHE . . . . . 0.738 ' HB3' ' HB2' ' B' ' 28' ' ' ARG . 33.8 p90 -155.28 153.37 30.49 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.018 0.437 . . . . 6.08 111.245 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.568 HG13 HG23 ' B' ' 107' ' ' ILE . 9.1 tt -88.03 113.26 24.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.651 -0.704 . . . . 5.57 110.47 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.443 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.7 OUTLIER -98.1 91.66 5.39 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.963 -0.562 . . . . 5.3 110.633 179.641 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 15' ' ' ARG . . . . . 0.62 ' HD3' ' HD2' ' B' ' 24' ' ' PHE . 8.7 mtp180 -82.56 111.22 18.35 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.884 -0.784 . . . . 8.97 108.884 179.281 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 16' ' ' HIS . . . . . 0.792 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 0.6 OUTLIER -146.51 172.5 13.46 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.367 -0.379 . . . . 8.31 111.425 -178.55 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -82.01 175.53 10.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.204 -0.453 . . . . 10.83 110.98 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 18.2 pt -58.82 -28.49 37.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 N-CA-C 113.039 0.755 . . . . 8.89 113.039 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -79.22 -10.37 59.8 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.882 0.372 . . . . 11.92 111.51 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 101.86 -8.35 55.99 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.452 -0.88 . . . . 8.57 112.987 179.26 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 21' ' ' ILE . . . . . 0.511 ' O ' ' HB2' ' B' ' 16' ' ' HIS . 24.8 mm -63.86 111.97 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 110.235 -0.283 . . . . 10.87 110.235 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 22' ' ' PHE . . . . . 0.792 ' HA ' ' HB3' ' B' ' 16' ' ' HIS . 97.4 m-85 -63.75 125.13 23.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.125 -0.489 . . . . 8.23 111.705 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 3.1 m -98.87 -44.47 6.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.537 -0.756 . . . . 7.91 110.605 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 24' ' ' PHE . . . . . 0.62 ' HD2' ' HD3' ' B' ' 15' ' ' ARG . 78.5 t80 -147.35 123.0 10.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.878 -0.601 . . . . 7.89 109.983 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 25.7 t -120.72 131.58 72.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.177 -0.465 . . . . 6.1 110.361 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -69.77 158.94 34.49 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.748 -0.464 . . . . 7.15 109.748 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 23.5 m-70 -78.2 51.03 0.96 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.29 -0.414 . . . . 8.97 111.717 -178.359 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 28' ' ' ARG . . . . . 0.83 ' HA ' ' HG3' ' B' ' 8' ' ' GLN . 23.5 mtm180 -125.37 -16.98 5.74 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.816 0.341 . . . . 9.76 110.583 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 22.7 p -61.71 -27.01 68.41 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.167 -0.469 . . . . 11.56 111.656 -179.037 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 34.0 t -59.75 -39.52 79.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.052 -0.522 . . . . 13.64 111.19 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.9 -15.4 39.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.332 -0.395 . . . . 12.9 111.285 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 32' ' ' THR . . . . . 0.746 ' HA ' HG22 ' B' ' 10' ' ' THR . 4.1 m -88.59 -53.27 4.73 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.254 0.464 . . . . 12.13 112.254 -178.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 33' ' ' VAL . . . . . 0.624 HG11 ' HD2' ' B' ' 78' ' ' PHE . 3.5 m -124.93 -13.07 5.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 112.455 0.539 . . . . 13.87 112.455 -178.837 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.1 -21.0 36.56 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.4 -0.905 . . . . 13.79 112.06 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -67.08 128.88 38.02 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.92 -0.4 . . . . 15.38 109.92 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 36' ' ' GLN . . . . . 0.566 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 12.4 mm100 -74.99 149.79 85.46 Favored Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 109.62 -0.511 . . . . 13.78 109.62 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.596 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 61.9 Cg_exo -51.4 -42.27 55.72 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.748 2.298 . . . . 14.71 112.503 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 -62.17 -27.92 69.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.907 -0.588 . . . . 17.54 111.577 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.566 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 30.6 mt-10 -72.84 -33.22 66.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.385 -0.371 . . . . 14.24 110.449 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.414 ' HB3' ' CG ' ' B' ' 22' ' ' PHE . 1.1 mm? -80.83 -30.89 35.69 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.104 -0.498 . . . . 14.03 111.106 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 79.6 mt -60.03 119.19 7.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 13.62 110.937 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.05 5.61 73.03 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.976 -0.63 . . . . 11.62 112.448 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.492 ' O ' ' HA ' ' B' ' 21' ' ' ILE . 1.7 mmpt? -116.64 154.29 30.79 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.63 0.252 . . . . 13.82 110.747 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 44' ' ' ASN . . . . . 0.938 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 15.3 m120 -89.47 135.4 33.62 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.542 -0.54 . . . . 10.16 109.542 179.331 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 45' ' ' ILE . . . . . 0.45 HG21 ' HZ ' ' B' ' 61' ' ' PHE . 19.0 tt -61.96 -26.39 39.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.156 0.503 . . . . 9.62 110.634 179.343 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 46' ' ' VAL . . . . . 0.539 HG12 ' HB3' ' B' ' 44' ' ' ASN . 14.4 p -71.24 -22.1 22.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 CA-C-N 115.815 -0.629 . . . . 11.5 111.353 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 47' ' ' GLU . . . . . 0.938 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 35.9 mt-10 -69.69 -35.86 75.47 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.087 0.47 . . . . 11.89 110.652 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 48' ' ' PHE . . . . . 0.4 ' HE2' ' HB3' ' B' ' 43' ' ' LYS . 16.8 m-85 -97.11 8.78 43.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.883 -0.599 . . . . 13.6 109.915 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 44.4 t -93.27 147.79 22.6 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.861 -0.609 . . . . 10.81 110.858 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 5.4 t-160 -58.7 128.75 84.26 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.47 -0.787 . . . . 11.49 109.595 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -46.91 -51.09 9.77 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.186 2.591 . . . . 11.35 113.412 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -68.35 -5.26 17.84 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.311 0.486 . . . . 9.28 112.311 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -120.8 5.5 10.48 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.692 0.282 . . . . 7.52 111.185 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -64.07 -52.43 59.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.443 -0.344 . . . . 6.57 111.312 -179.279 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 55' ' ' GLN . . . . . 0.541 ' OE1' ' HD3' ' B' ' 58' ' ' ARG . 51.9 tp60 -63.95 -30.8 71.85 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.849 -0.426 . . . . 6.58 109.849 179.107 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.7 tp -59.17 -50.55 73.59 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.213 -0.662 . . . . 4.6 109.213 178.435 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.438 ' HA ' HD23 ' B' ' 57' ' ' LEU . 0.3 OUTLIER -67.56 -41.42 84.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.765 -0.652 . . . . 6.4 109.88 178.837 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 58' ' ' ARG . . . . . 0.541 ' HD3' ' OE1' ' B' ' 55' ' ' GLN . 38.5 ttt180 -55.21 -53.46 55.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.484 -0.78 . . . . 8.18 111.358 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 59' ' ' ASP . . . . . 0.458 ' O ' ' HG3' ' B' ' 63' ' ' GLN . 22.3 t70 -62.71 -37.81 87.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.468 -0.333 . . . . 6.07 110.453 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 50.9 m -61.67 -35.56 78.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 5.59 110.58 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 61' ' ' PHE . . . . . 0.544 ' O ' HG12 ' B' ' 64' ' ' VAL . 8.1 m-85 -63.59 -43.31 97.34 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 121.042 0.449 . . . . 7.73 109.901 178.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 58.1 mm-40 -68.47 -34.95 76.83 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.475 -0.565 . . . . 6.89 109.475 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' B' ' 59' ' ' ASP . 52.9 mt-30 -61.67 -47.53 84.94 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.702 -0.681 . . . . 9.4 110.968 179.58 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.544 HG12 ' O ' ' B' ' 61' ' ' PHE . 4.0 p -65.45 -29.82 48.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.402 -0.363 . . . . 7.57 111.216 -179.27 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 65' ' ' VAL . . . . . 0.505 HG23 ' O ' ' B' ' 61' ' ' PHE . 72.7 t -69.54 -37.51 74.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 109.455 -0.572 . . . . 7.43 109.455 178.649 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -72.0 -27.28 62.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.663 -0.699 . . . . 10.21 110.081 178.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.484 ' HB3' ' HB2' ' B' ' 70' ' ' GLN . 52.2 mt -73.08 -61.69 1.73 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.646 -0.706 . . . . 7.2 110.531 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 37.0 mttt 65.52 108.99 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.298 0 O-C-N 123.876 0.735 . . . . 7.58 111.471 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 79.4 14.16 81.8 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.811 -0.709 . . . . 5.57 112.297 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.484 ' HB2' ' HB3' ' B' ' 67' ' ' LEU . 1.3 mp0 -125.19 157.37 36.65 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.237 -0.653 . . . . 5.43 109.237 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 71' ' ' VAL . . . . . 0.554 HG11 ' HA ' ' A' ' 8' ' ' GLN . 13.4 p -107.75 136.51 42.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.377 0.608 . . . . 5.65 111.121 -179.52 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 11.5 tp -123.25 111.44 16.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.696 -0.684 . . . . 4.51 109.938 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 73' ' ' SER . . . . . 0.412 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 0.3 OUTLIER -89.13 117.02 27.82 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.125 -0.489 . . . . 6.35 111.038 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 7.6 p -116.18 135.87 54.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.753 -0.462 . . . . 4.34 109.753 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 22.8 ttt -106.91 110.57 22.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.21 0.528 . . . . 5.42 111.142 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.411 ' HE2' ' HD1' ' B' ' 78' ' ' PHE . 45.1 p90 -137.07 -178.98 5.44 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.661 -0.7 . . . . 3.54 109.245 179.661 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 77' ' ' ARG . . . . . 0.583 ' HD2' ' HB3' ' B' ' 85' ' ' TRP . 37.9 mtm180 -106.5 122.2 45.81 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.08 0.467 . . . . 6.8 110.626 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.624 ' HD2' HG11 ' B' ' 33' ' ' VAL . 15.6 t80 -103.81 150.58 23.98 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.64 -0.709 . . . . 5.79 109.889 -179.419 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 79' ' ' ARG . . . . . 0.429 HH11 ' HD3' ' B' ' 79' ' ' ARG . 30.1 ttp180 -89.62 134.22 34.24 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.383 -0.371 . . . . 11.08 110.468 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 82.0 p -93.29 -176.38 4.12 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.217 -0.447 . . . . 7.47 110.087 179.331 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -70.73 -14.93 62.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.428 0.632 . . . . 12.24 109.391 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 68.5 m-20 -92.11 1.08 57.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.373 -0.83 . . . . 9.25 109.489 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 83' ' ' GLN . . . . . 0.425 ' HA ' ' HG2' ' B' ' 79' ' ' ARG . 2.3 mp0 67.03 22.79 9.9 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.167 -0.924 . . . . 8.3 111.241 -179.463 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -94.31 157.2 16.15 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.465 -0.569 . . . . 6.78 109.465 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 85' ' ' TRP . . . . . 0.583 ' HB3' ' HD2' ' B' ' 77' ' ' ARG . 81.6 m95 -99.38 116.45 31.57 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.832 0.348 . . . . 7.89 110.835 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 pp -119.32 145.83 45.81 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.174 -0.467 . . . . 6.97 110.027 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 87' ' ' TRP . . . . . 0.42 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 94.7 m95 -76.39 120.62 21.89 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.098 0.475 . . . . 8.55 110.777 -179.399 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 30.7 tpp -119.62 128.99 54.37 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.49 -0.777 . . . . 4.46 111.166 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 20.4 ttp180 -99.2 82.54 2.72 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.714 -0.847 . . . . 6.87 108.714 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 90' ' ' THR . . . . . 0.493 HG23 ' HB3' ' B' ' 108' ' ' CYS . 47.8 m -75.66 114.87 14.74 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.534 -0.757 . . . . 6.18 111.712 -178.711 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 91' ' ' SER . . . . . 0.412 ' HA ' ' HA ' ' B' ' 73' ' ' SER . 1.4 m -96.73 95.93 8.25 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.565 -0.743 . . . . 6.3 109.119 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 10.3 m -84.07 123.4 30.0 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.185 -0.461 . . . . 6.65 112.028 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 93' ' ' PHE . . . . . 0.46 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 65.0 t80 -120.48 122.58 40.97 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.92 -0.582 . . . . 6.45 109.555 179.123 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.79 113.89 21.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.708 0.29 . . . . 9.17 111.368 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 95' ' ' PHE . . . . . 0.491 ' HD1' ' HA ' ' B' ' 95' ' ' PHE . 0.0 OUTLIER -82.68 122.6 28.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 8.33 110.188 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -98.45 119.35 36.99 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.705 -0.679 . . . . 10.53 111.041 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 97' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -71.27 123.76 89.89 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 108.78 -0.822 . . . . 8.43 108.78 178.395 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.68 21.67 0.17 Allowed 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.023 2.482 . . . . 9.16 114.151 -178.706 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -94.69 -68.72 0.79 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.564 -0.532 . . . . 11.34 109.564 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 6.1 m -129.66 20.1 5.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.088 -0.505 . . . . 7.75 110.252 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 33.7 t70 66.72 41.54 2.93 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.349 -0.842 . . . . 9.08 111.19 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -96.2 140.06 31.45 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.403 -0.362 . . . . 7.71 110.258 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 63.5 mt -79.63 108.83 13.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.561 -0.533 . . . . 8.04 109.561 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.472 ' H ' ' HG2' ' B' ' 104' ' ' GLU . 6.4 pt-20 -72.94 -45.18 59.52 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.519 -0.309 . . . . 8.81 111.025 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -165.55 167.6 17.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.455 -0.339 . . . . 7.4 110.382 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 67.5 mt -106.0 121.85 58.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.959 -0.564 . . . . 6.78 110.155 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.568 HG23 HG13 ' B' ' 13' ' ' ILE . 83.4 mt -87.75 100.03 9.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.893 -0.594 . . . . 6.31 109.734 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 108' ' ' CYS . . . . . 0.493 ' HB3' HG23 ' B' ' 90' ' ' THR . 68.1 m -100.6 97.91 8.54 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 120.823 -0.351 . . . . 5.31 111.522 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 46.3 m -75.36 99.29 4.08 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.121 -0.696 . . . . 5.48 109.121 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 110' ' ' ASN . . . . . 0.553 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.3 m-20 -80.46 109.27 14.81 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.654 -0.703 . . . . 6.9 110.899 -178.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 111' ' ' THR . . . . . 0.472 HG23 ' HB2' ' B' ' 11' ' ' GLU . 0.3 OUTLIER -113.09 110.88 21.19 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.114 -0.494 . . . . 8.61 110.127 179.245 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 112' ' ' ASN . . . . . 0.722 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 10.8 t-20 -70.59 129.77 40.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.992 0.425 . . . . 11.84 110.754 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 38.8 t -106.36 -51.16 7.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.838 -0.619 . . . . 11.77 110.057 179.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 114' ' ' LYS . . . . . 0.42 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 34.4 mtpt . . . . . 0 C--O 1.246 0.889 0 CA-C-O 118.567 -0.73 . . . . 12.68 110.217 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.2 mm-40 . . . . . 0 C--O 1.234 0.288 0 N-CA-C 109.831 -0.433 . . . . 15.08 109.831 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.89 153.85 67.86 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.742 2.295 . . . . 13.43 112.751 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.812 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.2 OUTLIER -79.53 52.49 1.4 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.347 0.594 . . . . 11.09 111.079 179.609 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.496 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 40.8 tt0 -152.37 123.75 7.72 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.417 -0.81 . . . . 10.59 108.825 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.784 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 44.7 p90 -139.79 151.11 45.5 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.066 0.46 . . . . 8.93 111.732 -178.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.596 HG13 HD13 ' B' ' 107' ' ' ILE . 0.0 OUTLIER -111.32 129.31 66.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.784 -0.644 . . . . 8.66 109.866 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.5 m -134.32 139.29 45.57 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.316 0.579 . . . . 6.11 112.35 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.6 ' HD2' ' HD2' ' A' ' 24' ' ' PHE . 6.5 mtt85 -89.54 133.37 34.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.161 -0.927 . . . . 9.09 108.978 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.516 ' CB ' ' HA ' ' A' ' 22' ' ' PHE . 33.5 p80 -154.89 158.69 39.71 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.183 0.516 . . . . 9.79 111.751 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -65.85 155.7 35.53 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.992 -1.004 . . . . 12.69 109.278 178.563 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 18.4 pt -53.87 -31.02 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 N-CA-C 112.406 0.521 . . . . 13.58 112.406 -179.293 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -75.12 -16.59 60.53 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.821 0.343 . . . . 13.85 111.83 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 120.58 -19.48 9.08 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.308 -0.949 . . . . 9.38 113.553 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.487 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 30.6 mm -57.5 110.36 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 116.829 0.314 . . . . 10.74 110.978 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.516 ' HA ' ' CB ' ' A' ' 16' ' ' HIS . 82.3 m-85 -71.95 138.78 48.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.973 0.416 . . . . 9.73 111.457 -179.593 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.6 m -115.4 -36.9 4.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.756 -0.656 . . . . 7.74 110.891 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.6 ' HD2' ' HD2' ' A' ' 15' ' ' ARG . 18.6 t80 -139.48 110.7 6.95 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.409 -0.589 . . . . 6.92 109.409 179.318 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.546 HG21 ' HB2' ' A' ' 40' ' ' LEU . 7.3 t -97.61 150.24 4.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 116.447 -0.342 . . . . 6.02 110.776 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.784 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 7.8 t70 -69.35 172.58 6.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.704 -0.68 . . . . 7.31 110.087 179.581 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -91.02 -21.38 21.3 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.124 0.488 . . . . 11.67 109.828 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 76.5 mtm180 -84.41 5.69 26.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.633 -0.712 . . . . 11.91 111.943 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 4.5 p -59.94 -42.92 95.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.323 0.582 . . . . 12.99 110.441 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.1 t -66.45 -28.88 44.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.522 -0.763 . . . . 16.15 111.04 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.24 -6.12 59.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.16 -0.473 . . . . 15.07 111.684 -179.14 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.487 ' HA ' HG22 ' A' ' 10' ' ' THR . 18.4 m -109.71 -56.99 2.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.724 0.297 . . . . 14.9 111.334 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.593 HG23 ' H ' ' A' ' 35' ' ' TYR . 11.1 m -113.17 -19.61 6.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.704 0.288 . . . . 13.84 111.702 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 94.51 -8.84 71.73 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.462 -0.875 . . . . 13.85 112.359 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.593 ' H ' HG23 ' A' ' 33' ' ' VAL . 4.6 m-85 -74.01 136.76 43.17 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.377 -0.231 . . . . 18.28 110.377 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.529 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 12.0 mm100 -80.7 153.54 73.16 Favored Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 109.139 -0.689 . . . . 15.48 109.139 178.686 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.572 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 52.6 Cg_exo -53.56 -38.97 84.18 Favored 'Trans proline' 0 CA--C 1.529 0.237 0 C-N-CA 122.568 2.179 . . . . 11.63 112.712 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -71.11 -14.63 62.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.219 -0.446 . . . . 13.31 111.665 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.529 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 34.2 mt-10 -82.31 -20.65 36.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.911 0.386 . . . . 17.34 110.366 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.546 ' HB2' HG21 ' A' ' 25' ' ' VAL . 3.3 mm? -95.51 -24.11 16.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.771 -0.649 . . . . 13.25 110.495 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 82.5 mt -61.0 122.79 15.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.849 -0.614 . . . . 12.99 111.028 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLY . . . . . 0.405 ' HA2' HG23 ' A' ' 21' ' ' ILE . . . 76.31 9.18 85.82 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.879 -0.677 . . . . 13.39 112.586 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.738 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 9.0 mmpt? -114.1 153.39 29.57 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.908 0.385 . . . . 16.87 110.667 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.512 ' HB3' HG12 ' A' ' 46' ' ' VAL . 16.2 m120 -94.84 138.22 32.9 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.85 -0.613 . . . . 12.5 109.48 179.5 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.7 tt -61.14 -23.23 29.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.146 0.498 . . . . 11.72 110.856 179.679 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.512 HG12 ' HB3' ' A' ' 44' ' ' ASN . 11.5 p -70.8 -20.71 22.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 116.075 -0.511 . . . . 12.89 111.432 -179.669 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.405 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 45.3 mt-10 -72.75 -39.24 66.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.194 0.521 . . . . 16.53 110.461 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -97.36 19.44 13.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.679 -0.691 . . . . 15.34 110.396 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.506 ' SG ' HD12 ' A' ' 57' ' ' LEU . 49.8 t -104.56 149.5 25.45 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.837 -0.619 . . . . 11.97 110.513 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.406 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 4.9 t-160 -58.16 125.31 74.26 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.507 -0.77 . . . . 14.67 109.335 178.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.454 ' HA ' ' CD ' ' A' ' 54' ' ' GLN . 88.5 Cg_exo -48.89 -38.99 39.52 Favored 'Trans proline' 0 CA--C 1.533 0.452 0 C-N-CA 123.089 2.526 . . . . 15.15 113.823 -178.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -81.46 0.67 36.69 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.939 0.348 . . . . 16.47 111.939 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.406 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 36.7 m-20 -125.76 2.31 7.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.831 0.348 . . . . 13.16 110.978 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.454 ' CD ' ' HA ' ' A' ' 51' ' ' PRO . 85.5 mt-30 -61.99 -39.76 93.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.134 -0.484 . . . . 15.83 111.059 -179.395 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 -66.74 -44.38 81.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.262 -0.426 . . . . 13.94 110.211 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.2 tp -59.96 -41.97 93.08 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.218 -0.446 . . . . 12.11 110.37 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.506 HD12 ' SG ' ' A' ' 49' ' ' CYS . 0.2 OUTLIER -62.56 -53.09 59.91 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.003 -0.544 . . . . 9.71 110.114 179.307 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.427 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 52.7 ttt180 -59.77 -45.52 92.01 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.581 -0.736 . . . . 11.06 111.412 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -58.58 -46.72 86.32 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.335 -0.393 . . . . 9.71 111.025 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.3 m -66.46 -33.65 76.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.201 -0.454 . . . . 9.52 110.812 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.466 ' O ' HG12 ' A' ' 64' ' ' VAL . 1.8 m-30 -64.44 -30.08 71.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.065 0.459 . . . . 11.4 109.924 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 58' ' ' ARG . 87.7 mm-40 -79.13 -31.72 44.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.855 -0.611 . . . . 10.04 110.236 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -66.49 -42.49 87.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.876 -0.602 . . . . 10.6 110.972 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.466 HG12 ' O ' ' A' ' 61' ' ' PHE . 9.5 p -64.01 -25.98 39.43 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-O 121.011 0.434 . . . . 10.62 110.399 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.499 ' HA ' HG21 ' A' ' 94' ' ' THR . 82.7 t -72.58 -38.31 58.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 109.382 -0.599 . . . . 12.41 109.382 178.445 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 41.5 mtpt -68.98 -40.81 78.57 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.717 -0.674 . . . . 16.25 110.022 179.143 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.703 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 86.9 mt -62.57 -49.63 74.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.669 -0.696 . . . . 12.66 110.75 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 62.5 mttt 66.01 99.37 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.815 -0.63 . . . . 14.83 112.394 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 82.16 14.37 77.04 Favored Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 121.029 -0.605 . . . . 9.8 113.356 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.703 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 52.0 tp60 -119.74 123.62 44.19 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.551 -0.537 . . . . 9.59 109.551 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 6.8 p -71.35 126.32 31.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.297 0.57 . . . . 8.1 111.128 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 22.4 tp -115.73 123.97 49.64 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.811 -0.631 . . . . 7.8 109.706 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -92.54 116.7 29.23 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.085 -0.507 . . . . 7.59 111.262 -179.48 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.1 p -119.56 122.8 69.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.106 0.479 . . . . 7.84 110.253 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 11.7 ttt -100.36 127.31 46.71 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.259 -0.428 . . . . 9.35 111.172 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.502 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 45.3 p90 -154.18 -179.57 8.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.915 -0.584 . . . . 9.66 109.755 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.474 ' HD2' ' HB3' ' A' ' 85' ' ' TRP . 11.4 mtm180 -100.86 119.83 39.25 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.907 0.384 . . . . 13.1 109.987 179.25 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.502 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 21.5 t80 -104.9 150.59 24.74 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.883 -0.598 . . . . 9.28 110.475 -179.105 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.54 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 28.3 ttp180 -86.5 133.08 33.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.323 -0.399 . . . . 10.87 110.573 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 59.8 p -93.11 -175.36 3.83 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.675 -0.491 . . . . 10.77 109.675 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.464 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 37.6 tptt -72.24 -14.65 61.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.25 0.548 . . . . 12.66 109.704 178.514 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -95.48 5.23 52.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.729 -0.668 . . . . 14.42 109.768 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 68.08 23.58 8.02 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.162 -0.926 . . . . 12.69 112.018 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.5 pt-20 -94.01 161.88 14.11 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.789 -0.449 . . . . 10.85 109.789 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.54 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 81.7 m95 -107.16 106.16 16.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.816 0.341 . . . . 11.2 110.288 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.486 HD21 HG12 ' A' ' 33' ' ' VAL . 1.6 pp -105.78 148.67 27.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.198 -0.455 . . . . 11.12 110.866 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.673 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 96.3 m95 -81.29 117.18 21.57 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.294 -0.412 . . . . 10.28 110.068 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.484 ' SD ' ' HB3' ' A' ' 110' ' ' ASN . 3.7 ttp -130.61 141.52 50.44 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.255 -0.43 . . . . 9.32 111.193 -179.015 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -103.25 100.49 10.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.717 -0.674 . . . . 10.66 109.323 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.525 HG23 ' HB3' ' A' ' 108' ' ' CYS . 37.7 m -82.91 113.93 20.85 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.247 0.546 . . . . 9.37 111.511 -179.289 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.673 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 0.7 OUTLIER -91.78 91.15 7.81 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.688 -0.856 . . . . 8.27 108.688 178.382 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.1 m -82.0 131.07 35.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.075 -0.511 . . . . 8.65 111.896 -178.097 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -127.12 121.6 31.88 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.771 -0.65 . . . . 11.56 109.812 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.499 HG21 ' HA ' ' A' ' 65' ' ' VAL . 0.0 OUTLIER -76.31 111.28 11.58 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.911 0.386 . . . . 10.16 110.695 179.717 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -81.44 100.73 9.44 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.136 0.493 . . . . 12.25 110.049 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.518 ' HG2' HG12 ' A' ' 103' ' ' ILE . 37.4 mt-30 -90.2 152.99 20.84 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.732 -0.667 . . . . 14.24 111.31 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.446 ' OD1' ' HB2' ' A' ' 99' ' ' TYR . 15.6 t-20 -102.82 130.35 23.99 Favored Pre-proline 0 C--N 1.32 -0.684 0 CA-C-N 115.427 -0.806 . . . . 13.83 109.046 179.049 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -76.22 54.62 4.29 Favored 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.576 2.184 . . . . 15.34 112.876 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.446 ' HB2' ' OD1' ' A' ' 97' ' ' ASN . 4.3 t80 -125.95 -55.25 1.49 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 16.89 110.348 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -138.41 22.2 2.75 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.983 -0.553 . . . . 14.89 109.746 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 10.0 t70 63.29 33.23 14.24 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.59 -0.732 . . . . 14.77 110.021 -179.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -90.45 162.58 15.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.92 -0.582 . . . . 12.95 110.289 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.518 HG12 ' HG2' ' A' ' 96' ' ' GLN . 43.8 mt -110.58 119.85 60.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.78 -0.452 . . . . 11.11 109.78 179.406 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.81 -40.76 27.85 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.856 -0.338 . . . . 11.65 110.737 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 14.4 p90 -169.16 -178.18 3.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.258 -0.428 . . . . 10.3 110.209 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 73.0 mt -121.59 127.16 75.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.876 0.37 . . . . 10.29 110.88 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.564 HG22 HG22 ' A' ' 13' ' ' ILE . 19.3 mt -99.62 122.3 51.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 108.623 -0.88 . . . . 8.99 108.623 178.554 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.525 ' HB3' HG23 ' A' ' 90' ' ' THR . 81.5 m -110.26 132.21 54.37 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.255 0.55 . . . . 9.83 112.452 -178.459 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.707 HG21 HG13 ' B' ' 13' ' ' ILE . 12.8 m -100.27 95.8 7.03 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.776 -1.102 . . . . 10.84 108.447 178.177 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.496 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 6.7 m-20 -81.93 105.85 13.38 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.093 -0.503 . . . . 11.26 111.839 -178.121 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 1.7 m -102.3 112.56 25.31 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.802 -0.635 . . . . 11.22 110.085 178.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ASN . . . . . 0.812 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 10.0 t-20 -72.47 125.28 27.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.905 0.383 . . . . 12.78 110.55 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 46.4 t -102.98 -50.21 9.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.158 -0.474 . . . . 14.64 109.897 179.677 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.673 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 89.8 mttt . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.283 -0.865 . . . . 16.02 110.09 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 80.3 m . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 109.939 -0.393 . . . . 7.49 109.939 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 8' ' ' GLN . . . . . 0.411 ' HA ' ' HD3' ' B' ' 9' ' ' PRO . 18.5 mm-40 -133.74 146.32 59.76 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 116.646 -0.252 . . . . 7.12 110.537 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 9' ' ' PRO . . . . . 0.706 ' HD2' ' HG2' ' B' ' 28' ' ' ARG . 18.1 Cg_exo -67.54 167.57 20.46 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 123.025 2.483 . . . . 6.18 112.104 179.306 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.97 57.89 3.62 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.479 0.656 . . . . 5.81 111.136 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.508 ' HA ' ' O ' ' B' ' 110' ' ' ASN . 0.0 OUTLIER -166.62 148.62 6.46 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.315 -0.995 . . . . 5.85 108.315 179.043 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 47.7 p90 -156.21 162.74 40.14 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.422 0.629 . . . . 6.08 112.06 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.707 HG13 HG21 ' A' ' 109' ' ' THR . 27.0 mm -96.33 117.35 40.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 114.912 -1.04 . . . . 5.57 110.409 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.468 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.9 OUTLIER -106.86 101.86 11.26 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.005 -0.543 . . . . 5.3 110.831 -179.769 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 15' ' ' ARG . . . . . 0.562 ' HD3' ' HB3' ' B' ' 24' ' ' PHE . 26.8 mtp85 -91.94 108.01 19.62 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.175 -0.676 . . . . 8.97 109.175 179.342 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 16' ' ' HIS . . . . . 0.553 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 31.9 p80 -139.55 164.46 29.84 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.345 -0.389 . . . . 8.31 110.897 -178.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 10.8 p-10 -75.71 -177.83 3.92 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.408 -0.36 . . . . 10.83 110.48 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 33.9 pt -65.64 -28.17 43.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 112.455 0.539 . . . . 8.89 112.455 -178.366 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -72.69 -32.75 66.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.724 0.297 . . . . 11.92 110.934 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 125.58 -11.4 7.52 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.578 -0.82 . . . . 8.57 112.267 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 21' ' ' ILE . . . . . 0.406 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 39.3 mm -62.12 112.64 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.775 0.321 . . . . 10.87 110.388 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 22' ' ' PHE . . . . . 0.553 ' HA ' ' HB3' ' B' ' 16' ' ' HIS . 97.2 m-85 -69.81 129.68 40.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.97 -0.559 . . . . 8.23 111.279 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.85 -33.91 7.82 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.82 -0.627 . . . . 7.91 110.607 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 24' ' ' PHE . . . . . 0.562 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 37.8 t80 -152.05 124.69 8.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.33 -0.396 . . . . 7.89 110.483 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 4.8 t -125.88 141.11 46.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.077 -0.511 . . . . 6.1 109.973 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -73.68 159.81 32.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.899 0.381 . . . . 7.15 110.222 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 89.3 m-70 -69.28 -10.34 57.39 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.088 -0.506 . . . . 8.97 112.036 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 28' ' ' ARG . . . . . 0.706 ' HG2' ' HD2' ' B' ' 9' ' ' PRO . 60.9 mtm180 -67.1 -20.06 65.73 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.429 0.529 . . . . 9.76 112.429 -179.202 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 32.1 p -59.75 -29.86 68.45 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.144 0.424 . . . . 11.56 112.144 -178.633 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.435 ' O ' ' HA2' ' B' ' 34' ' ' GLY . 21.8 t -61.94 -37.57 78.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.216 -0.447 . . . . 13.64 112.059 -178.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -91.85 -12.65 33.05 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.019 0.438 . . . . 12.9 111.181 -179.459 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 16.3 m -88.14 -64.71 1.1 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.252 -0.431 . . . . 12.13 111.368 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 33' ' ' VAL . . . . . 0.538 HG23 ' H ' ' B' ' 35' ' ' TYR . 6.9 m -108.64 -13.0 10.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.755 0.312 . . . . 13.87 111.614 -179.215 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 34' ' ' GLY . . . . . 0.435 ' HA2' ' O ' ' B' ' 30' ' ' VAL . . . 89.65 -12.68 66.32 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.573 -0.822 . . . . 13.79 112.003 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 35' ' ' TYR . . . . . 0.538 ' H ' HG23 ' B' ' 33' ' ' VAL . 14.9 m-85 -73.12 141.2 47.49 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.682 0.277 . . . . 15.38 110.632 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 36' ' ' GLN . . . . . 0.557 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 14.4 mm100 -84.64 148.65 52.31 Favored Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 108.902 -0.777 . . . . 13.78 108.902 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.715 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 52.4 Cg_exo -52.63 -39.78 74.91 Favored 'Trans proline' 0 N--CA 1.465 -0.153 0 C-N-CA 122.301 2.001 . . . . 14.71 111.986 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 26.0 mp0 -65.9 -20.24 66.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.938 -0.573 . . . . 17.54 112.22 -179.375 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.557 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 42.6 mt-10 -79.15 -39.35 33.74 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.892 -0.41 . . . . 14.24 109.892 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -73.41 -34.21 65.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.905 -0.589 . . . . 14.03 111.207 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.715 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 56.6 mt -59.18 114.66 2.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.96 0.409 . . . . 13.62 111.304 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 98.32 -7.72 62.11 Favored Glycine 0 N--CA 1.45 -0.422 0 CA-C-N 115.825 -0.625 . . . . 11.62 112.44 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.442 ' HE2' ' HA ' ' B' ' 43' ' ' LYS . 1.4 mmpt? -108.47 166.68 10.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.74 0.305 . . . . 13.82 110.925 -179.629 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 44' ' ' ASN . . . . . 0.805 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 12.8 m120 -103.04 149.33 24.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.801 -0.636 . . . . 10.16 109.959 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 18.9 tt -71.48 -27.34 28.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.957 0.408 . . . . 9.62 110.819 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 9.9 p -71.76 -20.53 20.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-O 120.986 0.422 . . . . 11.5 111.413 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 47' ' ' GLU . . . . . 0.805 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 41.8 mt-10 -70.52 -34.47 72.34 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.254 -0.43 . . . . 11.89 110.98 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -103.08 26.3 8.39 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.109 -0.496 . . . . 13.6 110.147 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 49.8 t -107.57 152.55 24.11 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.001 -0.545 . . . . 10.81 111.082 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 50' ' ' HIS . . . . . 0.456 ' HB2' ' HB2' ' B' ' 77' ' ' ARG . 8.8 t-80 -63.92 130.29 94.38 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 115.401 -0.818 . . . . 11.49 109.538 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 51' ' ' PRO . . . . . 0.436 ' HD2' ' CD2' ' B' ' 50' ' ' HIS . 85.9 Cg_exo -43.53 -51.18 6.28 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.606 2.871 . . . . 11.35 114.438 -179.307 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -72.98 -3.91 28.96 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.375 0.509 . . . . 9.28 112.375 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 53' ' ' ASP . . . . . 0.603 ' HB3' ' HB2' ' B' ' 76' ' ' PHE . 14.8 m-20 -118.35 3.86 11.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.986 0.422 . . . . 7.52 110.692 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -68.2 -48.23 65.79 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.919 -0.582 . . . . 6.57 111.524 -178.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 49.7 tp60 -65.23 -33.49 76.12 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.858 -0.423 . . . . 6.58 109.858 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 22.0 tp -61.38 -39.23 89.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.963 -0.562 . . . . 4.6 109.993 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 1.1 mt -66.39 -47.47 73.23 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.786 -0.643 . . . . 6.4 110.272 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -61.95 -46.09 90.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.807 -0.633 . . . . 8.18 111.036 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -58.95 -45.68 89.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.47 . . . . 6.07 111.056 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 15.7 m -66.84 -36.4 82.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.247 -0.433 . . . . 5.59 110.869 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 61' ' ' PHE . . . . . 0.633 ' O ' HG12 ' B' ' 64' ' ' VAL . 1.7 m-30 -64.64 -42.8 95.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.732 0.301 . . . . 7.73 110.539 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 84.3 mm-40 -65.17 -28.75 69.62 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.079 0.466 . . . . 6.89 110.405 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -76.82 -37.86 54.94 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.993 -0.549 . . . . 9.4 111.021 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.727 ' HA ' HD12 ' B' ' 67' ' ' LEU . 2.8 p -65.74 -27.46 41.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 CA-C-O 120.775 0.321 . . . . 7.57 110.474 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 65' ' ' VAL . . . . . 0.444 HG23 ' O ' ' B' ' 61' ' ' PHE . 92.4 t -69.77 -34.77 62.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.327 0.585 . . . . 7.43 109.605 178.613 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -80.27 -18.26 49.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.636 -0.711 . . . . 10.21 110.439 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.85 ' HB3' ' HB2' ' B' ' 70' ' ' GLN . 64.8 mt -74.3 -46.92 38.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.862 -0.608 . . . . 7.2 110.572 179.326 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 86.2 mttt 56.6 88.46 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.85 0.719 . . . . 7.58 112.538 179.16 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.55 -4.0 63.73 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.431 -0.89 . . . . 5.57 112.533 178.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.85 ' HB2' ' HB3' ' B' ' 67' ' ' LEU . 2.3 mp0 -104.68 141.53 36.28 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 110.164 -0.31 . . . . 5.43 110.164 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 71' ' ' VAL . . . . . 0.832 ' HB ' ' HD1' ' B' ' 93' ' ' PHE . 7.1 p -92.94 132.33 37.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.151 0.5 . . . . 5.65 111.054 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 14.9 tp -119.98 111.73 18.28 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.917 -0.583 . . . . 4.51 109.435 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 73' ' ' SER . . . . . 0.611 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.2 p -91.24 110.29 21.57 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.208 -0.451 . . . . 6.35 110.926 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.1 p -103.83 128.69 56.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.122 -0.49 . . . . 4.34 110.107 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 28.4 ttt -99.29 109.11 21.78 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.366 -0.379 . . . . 5.42 110.292 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.603 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 51.5 p90 -138.6 -173.64 3.61 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.058 -0.519 . . . . 3.54 110.121 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 77' ' ' ARG . . . . . 0.456 ' HB2' ' HB2' ' B' ' 50' ' ' HIS . 26.3 mtt180 -106.64 115.61 30.49 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.754 0.311 . . . . 6.8 110.32 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -102.64 149.45 24.43 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.035 -0.53 . . . . 5.79 110.021 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 79' ' ' ARG . . . . . 0.584 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 17.5 ttp180 -88.88 133.06 34.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.925 0.393 . . . . 11.08 110.618 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 80' ' ' SER . . . . . 0.492 ' OG ' ' HG2' ' B' ' 84' ' ' GLU . 91.0 p -94.58 -176.33 3.88 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.683 -0.488 . . . . 7.47 109.683 178.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 81' ' ' LYS . . . . . 0.444 ' HA ' ' HD2' ' B' ' 81' ' ' LYS . 40.2 tptt -68.26 -16.22 63.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.27 0.557 . . . . 12.24 110.014 179.077 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -88.11 -0.54 57.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.678 -0.692 . . . . 9.25 109.884 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 65.93 28.78 10.54 Favored 'General case' 0 C--N 1.334 -0.076 0 CA-C-N 115.551 -0.75 . . . . 8.3 110.795 -179.396 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 84' ' ' GLU . . . . . 0.492 ' HG2' ' OG ' ' B' ' 80' ' ' SER . 12.2 pt-20 -106.53 163.72 12.65 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.031 -0.729 . . . . 6.78 109.031 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 85' ' ' TRP . . . . . 0.584 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 49.9 m95 -105.15 127.76 53.06 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.135 0.493 . . . . 7.89 111.426 -179.247 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -129.26 151.3 50.06 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.792 -0.64 . . . . 6.97 109.814 179.049 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 87' ' ' TRP . . . . . 0.541 ' HD1' ' HB2' ' B' ' 114' ' ' LYS . 98.8 m95 -75.65 111.57 11.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.358 0.599 . . . . 8.55 110.511 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 88' ' ' MET . . . . . 0.414 ' SD ' ' HB3' ' B' ' 110' ' ' ASN . 47.0 tpp -116.0 123.44 48.01 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.248 -0.887 . . . . 4.46 110.722 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 33.3 ttp180 -97.76 83.27 3.16 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.592 -0.892 . . . . 6.87 108.592 178.439 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 90' ' ' THR . . . . . 0.636 HG23 ' HB3' ' B' ' 108' ' ' CYS . 36.2 m -72.06 109.45 5.87 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.418 -0.81 . . . . 6.18 111.231 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 91' ' ' SER . . . . . 0.67 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 1.9 m -90.38 87.89 6.97 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.697 -0.683 . . . . 6.3 109.339 179.187 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 92' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' B' ' 108' ' ' CYS . 9.2 m -75.39 120.46 20.87 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.84 -0.618 . . . . 6.65 111.517 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 93' ' ' PHE . . . . . 0.832 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 55.8 t80 -116.88 124.22 48.94 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.943 -0.572 . . . . 6.45 110.085 179.616 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 94' ' ' THR . . . . . 0.522 HG22 HG21 ' B' ' 103' ' ' ILE . 0.3 OUTLIER -83.69 103.26 12.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.881 0.372 . . . . 9.17 110.691 179.76 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 95' ' ' PHE . . . . . 0.483 ' CZ ' ' HB ' ' A' ' 13' ' ' ILE . 0.0 OUTLIER -74.62 117.17 16.15 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.156 -0.474 . . . . 8.33 110.52 -179.647 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -83.25 116.91 22.62 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.751 -0.659 . . . . 10.53 110.584 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 97' ' ' ASN . . . . . 0.484 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 62.7 t30 -80.74 127.84 73.83 Favored Pre-proline 0 C--N 1.322 -0.625 0 N-CA-C 109.251 -0.648 . . . . 8.43 109.251 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 98' ' ' PRO . . . . . 0.484 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 23.5 Cg_endo -62.32 73.27 0.11 Allowed 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.257 2.638 . . . . 9.16 113.054 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 99' ' ' TYR . . . . . 0.424 ' HB3' ' H ' ' B' ' 100' ' ' SER . 3.6 m-85 -147.4 -137.58 0.09 Allowed 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.818 -0.808 . . . . 11.34 108.818 179.425 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 100' ' ' SER . . . . . 0.424 ' H ' ' HB3' ' B' ' 99' ' ' TYR . 0.3 OUTLIER -80.54 49.3 1.15 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.665 0.269 . . . . 7.75 110.968 179.437 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 38.8 t70 50.53 77.0 0.13 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.719 -0.673 . . . . 9.08 111.101 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 102' ' ' GLU . . . . . 0.463 ' HG3' ' HB3' ' B' ' 97' ' ' ASN . 3.4 pt-20 -133.43 151.46 51.8 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.946 0.403 . . . . 7.71 111.459 -179.143 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 103' ' ' ILE . . . . . 0.522 HG21 HG22 ' B' ' 94' ' ' THR . 40.2 mt -94.9 98.3 7.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.638 -0.71 . . . . 8.04 109.146 178.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -58.45 -47.8 82.8 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.985 -0.552 . . . . 8.81 110.723 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 105' ' ' TYR . . . . . 0.445 ' HE1' HD11 ' B' ' 107' ' ' ILE . 8.1 p90 -161.31 163.49 30.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.104 -0.498 . . . . 7.4 110.133 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 62.6 mt -105.16 114.32 44.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.896 -0.593 . . . . 6.78 109.686 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.688 HG23 HG23 ' B' ' 13' ' ' ILE . 88.1 mt -86.87 104.21 13.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.008 -0.542 . . . . 6.31 109.697 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 108' ' ' CYS . . . . . 0.636 ' HB3' HG23 ' B' ' 90' ' ' THR . 75.6 m -94.43 108.49 20.41 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.967 -0.561 . . . . 5.31 111.632 -179.179 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 109' ' ' THR . . . . . 0.67 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 27.5 m -82.47 90.94 6.79 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.94 -0.763 . . . . 5.48 108.94 177.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 110' ' ' ASN . . . . . 0.508 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.0 m-20 -72.24 106.86 4.59 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.836 -0.62 . . . . 6.9 111.363 -178.599 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 1.4 m -108.72 109.03 20.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.308 -0.406 . . . . 8.61 110.189 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -70.95 127.07 31.35 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.987 0.422 . . . . 11.84 110.586 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 113' ' ' VAL . . . . . 0.4 HG12 ' HG3' ' B' ' 114' ' ' LYS . 35.2 t -100.23 -55.46 5.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.769 -0.65 . . . . 11.77 109.751 179.575 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 114' ' ' LYS . . . . . 0.541 ' HB2' ' HD1' ' B' ' 87' ' ' TRP . 45.4 mtpt . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.516 -0.754 . . . . 12.68 109.703 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.7 mm-40 . . . . . 0 N--CA 1.454 -0.265 0 N-CA-C 109.689 -0.485 . . . . 15.08 109.689 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.65 164.85 34.41 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.769 2.312 . . . . 13.43 112.556 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.716 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.2 OUTLIER -82.89 52.0 2.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.154 0.502 . . . . 11.09 110.975 179.737 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.44 ' HB2' HG23 ' A' ' 111' ' ' THR . 40.2 tt0 -156.41 129.97 8.26 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.782 -0.645 . . . . 10.59 109.479 -179.298 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.945 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 39.4 p90 -144.83 145.11 31.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.937 0.399 . . . . 8.93 111.425 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.51 HG23 HG23 ' A' ' 107' ' ' ILE . 2.5 mp -93.57 117.93 38.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 109.795 -0.446 . . . . 8.66 109.795 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 52.8 p -105.16 121.97 44.94 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.233 0.539 . . . . 6.11 111.057 -179.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.9 mtp180 -97.85 102.9 14.77 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.303 -0.999 . . . . 9.09 108.303 178.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.407 ' O ' ' HB2' ' A' ' 105' ' ' TYR . 31.8 p80 -130.46 153.85 48.36 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.511 -0.313 . . . . 9.79 110.931 -178.598 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -69.18 173.98 5.1 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.475 -0.329 . . . . 12.69 110.236 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.0 pt -58.83 -29.51 40.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 112.802 0.667 . . . . 13.58 112.802 -178.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -73.94 -21.38 60.06 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.887 0.375 . . . . 13.85 111.465 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 112.12 -0.93 26.92 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 120.436 -0.888 . . . . 9.38 112.509 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.423 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 40.2 mm -72.98 118.45 18.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.679 -0.489 . . . . 10.74 109.679 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.418 ' CG ' ' HB3' ' A' ' 40' ' ' LEU . 86.9 m-85 -69.41 113.63 6.89 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.183 -0.462 . . . . 9.73 111.507 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.83 -35.95 23.85 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.355 0.598 . . . . 7.74 109.659 178.83 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -152.78 125.85 8.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.312 -0.858 . . . . 6.92 108.985 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.62 HG21 ' HB2' ' A' ' 40' ' ' LEU . 2.5 t -110.35 147.88 14.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.953 0.406 . . . . 6.02 111.414 -178.769 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.945 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 6.4 t70 -68.81 168.9 12.46 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.874 -0.603 . . . . 7.31 109.764 179.145 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 60.5 m170 -95.34 -11.96 26.9 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.995 0.426 . . . . 11.67 110.574 -179.403 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 85.6 mtm180 -82.0 -5.94 58.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.895 -0.593 . . . . 11.91 111.947 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.6 p -60.88 -27.37 68.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.867 0.365 . . . . 12.99 111.163 -179.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.436 ' O ' ' HA2' ' A' ' 34' ' ' GLY . 15.0 t -65.14 -32.67 59.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.045 -0.525 . . . . 16.15 110.823 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.52 -27.19 21.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.182 -0.463 . . . . 15.07 110.787 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.559 ' HA ' HG22 ' A' ' 10' ' ' THR . 4.0 m -76.63 -55.37 5.57 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.114 -0.494 . . . . 14.9 111.376 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.568 HG11 ' HD2' ' A' ' 78' ' ' PHE . 2.7 m -120.13 -30.07 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 111.871 0.322 . . . . 13.84 111.871 -179.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.436 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 110.48 -23.57 19.91 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.307 -0.949 . . . . 13.85 112.015 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -65.58 135.86 55.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.743 0.306 . . . . 18.28 110.529 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.638 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 17.7 mm100 -77.3 150.41 80.11 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 109.16 -0.682 . . . . 15.48 109.16 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.567 ' HB3' ' HB ' ' A' ' 25' ' ' VAL . 53.6 Cg_exo -52.36 -40.0 71.82 Favored 'Trans proline' 0 CA--C 1.528 0.202 0 C-N-CA 122.443 2.095 . . . . 11.63 112.05 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.579 ' HA ' HD12 ' A' ' 41' ' ' LEU . 25.7 mp0 -65.6 -20.34 66.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.621 -0.718 . . . . 13.31 111.612 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.638 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 29.3 mt-10 -78.74 -28.14 44.89 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.146 -0.316 . . . . 17.34 110.146 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.62 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.7 mm? -86.58 -26.9 24.23 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.879 -0.601 . . . . 13.25 110.791 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.579 HD12 ' HA ' ' A' ' 38' ' ' GLN . 96.7 mt -60.43 119.34 7.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.106 -0.497 . . . . 12.99 110.824 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.9 3.8 82.8 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 121.01 -0.614 . . . . 13.39 112.41 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.517 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 8.3 mmpt? -113.95 161.2 17.95 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.224 -0.287 . . . . 16.87 110.224 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.653 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 16.8 m120 -98.06 136.37 38.41 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.669 -0.493 . . . . 12.5 109.669 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.493 HD13 ' HZ ' ' A' ' 61' ' ' PHE . 13.8 tt -58.8 -27.55 35.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.106 0.479 . . . . 11.72 110.992 179.413 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.2 p -71.21 -18.68 20.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.051 -0.522 . . . . 12.89 111.56 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.653 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.0 mt-10 -71.14 -34.63 71.21 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.035 0.445 . . . . 16.53 110.901 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.414 ' HB2' ' CZ ' ' A' ' 78' ' ' PHE . 30.7 m-85 -100.45 24.14 9.31 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.903 -0.59 . . . . 15.34 110.471 -179.147 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 46.0 t -110.57 150.19 29.3 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.059 -0.519 . . . . 11.97 110.063 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.527 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 6.8 t-160 -58.33 125.17 74.51 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 109.133 -0.691 . . . . 14.67 109.133 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_exo -45.63 -46.36 15.04 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 123.189 2.592 . . . . 15.15 113.679 -179.014 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -75.82 0.03 19.48 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.121 0.415 . . . . 16.47 112.121 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.527 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 9.5 m-20 -122.03 -0.17 9.54 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.963 0.411 . . . . 13.16 110.246 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -63.9 -45.47 89.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.791 -0.64 . . . . 15.83 111.557 -179.35 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.7 tp60 -66.46 -37.0 84.18 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.433 -0.58 . . . . 13.94 109.433 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.8 tp -59.48 -42.1 91.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.727 -0.67 . . . . 12.11 109.445 178.413 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -67.73 -51.24 51.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.521 -0.763 . . . . 9.71 110.327 179.159 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -57.29 -47.22 82.03 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.767 -0.651 . . . . 11.06 111.606 -179.219 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.478 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 31.3 t70 -58.96 -45.89 89.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.32 -0.4 . . . . 9.71 110.983 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.4 m -65.87 -33.27 75.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.966 -0.561 . . . . 9.52 111.022 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.593 ' O ' HG12 ' A' ' 64' ' ' VAL . 1.9 m-85 -62.88 -39.47 94.54 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.051 0.453 . . . . 11.4 110.163 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 87.2 mm-40 -70.22 -32.0 69.68 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.043 -0.526 . . . . 10.04 110.092 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.645 ' HA ' ' HD3' ' A' ' 66' ' ' LYS . 65.7 mt-30 -66.08 -39.02 89.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.95 -0.568 . . . . 10.6 111.219 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.593 HG12 ' O ' ' A' ' 61' ' ' PHE . 2.3 p -68.14 -25.38 31.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.854 0.359 . . . . 10.62 110.687 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.427 ' O ' ' HG3' ' A' ' 68' ' ' LYS . 86.6 t -73.6 -34.82 42.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 N-CA-C 109.157 -0.683 . . . . 12.41 109.157 178.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.645 ' HD3' ' HA ' ' A' ' 63' ' ' GLN . 45.3 mtpt -72.23 -38.99 68.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.518 -0.765 . . . . 16.25 109.634 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 65.9 mt -66.01 -53.49 38.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.296 -0.865 . . . . 12.66 111.034 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' A' ' 65' ' ' VAL . 62.7 mttt 60.33 91.46 0.05 Allowed 'General case' 0 N--CA 1.466 0.326 0 O-C-N 123.658 0.599 . . . . 14.83 112.38 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 105.74 -13.6 46.15 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.726 -0.75 . . . . 9.8 112.804 179.105 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.521 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 6.3 tp-100 -96.67 126.25 41.7 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.269 -0.271 . . . . 9.59 110.269 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.448 ' HA ' ' O ' ' A' ' 92' ' ' SER . 2.4 p -80.75 112.93 19.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.333 0.587 . . . . 8.1 110.587 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.3 tp -104.29 117.33 33.94 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.616 -0.72 . . . . 7.8 110.398 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.76 106.93 18.39 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.863 -0.608 . . . . 7.59 111.193 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.472 HG13 ' HB ' ' A' ' 90' ' ' THR . 2.6 p -101.28 122.98 54.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.112 0.482 . . . . 7.84 109.867 179.184 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 23.6 ttt -99.78 118.42 36.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.243 -0.435 . . . . 9.35 110.954 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.588 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 45.4 p90 -145.9 -171.65 3.75 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.663 -0.699 . . . . 9.66 109.279 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.454 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 44.9 mtm180 -110.55 120.12 41.39 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.055 0.455 . . . . 13.1 110.398 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.588 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 12.7 t80 -102.25 151.88 21.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.316 -0.856 . . . . 9.28 110.15 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.492 ' HA ' ' O ' ' A' ' 84' ' ' GLU . 37.9 ttp180 -88.61 128.16 35.58 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.171 -0.468 . . . . 10.87 110.471 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.474 ' HA ' ' HB ' ' A' ' 33' ' ' VAL . 54.9 p -88.47 -176.25 5.25 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.299 -0.41 . . . . 10.77 110.025 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.4 tptt -72.33 -14.23 61.69 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.104 -0.702 . . . . 12.66 109.104 178.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -90.74 1.38 56.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.316 -0.856 . . . . 14.42 109.489 178.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 67.82 22.91 8.63 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.207 -0.906 . . . . 12.69 111.316 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.492 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.5 pt-20 -96.1 167.95 10.9 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.755 -0.461 . . . . 10.85 109.755 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.464 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 77.2 m95 -108.92 108.31 19.02 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.582 -0.281 . . . . 11.2 110.562 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.529 HD21 HG12 ' A' ' 33' ' ' VAL . 2.6 pp -110.0 151.09 27.58 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.488 -0.324 . . . . 11.12 110.365 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.538 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 96.9 m95 -77.59 119.66 21.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.039 0.447 . . . . 10.28 110.527 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.437 ' SD ' ' HB3' ' A' ' 110' ' ' ASN . 30.5 tpp -119.2 135.41 54.69 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.776 -0.647 . . . . 9.32 111.063 -178.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -104.72 81.69 1.8 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.65 -0.87 . . . . 10.66 108.65 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.598 HG23 ' HB3' ' A' ' 108' ' ' CYS . 28.7 m -71.38 109.51 5.41 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.689 -0.687 . . . . 9.37 111.963 -178.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.487 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 0.7 OUTLIER -87.51 93.42 9.41 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.431 -0.804 . . . . 8.27 108.982 178.697 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.448 ' O ' ' HA ' ' A' ' 71' ' ' VAL . 16.4 m -81.91 124.02 29.35 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.04 0.448 . . . . 8.65 111.452 -178.628 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -125.63 125.06 42.52 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.746 -0.661 . . . . 11.56 109.93 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.69 129.51 37.22 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.297 -0.411 . . . . 10.16 111.474 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -114.04 109.97 19.29 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.376 -0.375 . . . . 12.25 110.079 179.496 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.41 ' HG3' HG12 ' A' ' 103' ' ' ILE . 0.0 OUTLIER -112.55 152.91 28.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.997 0.427 . . . . 14.24 110.966 -179.694 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -92.37 145.87 31.43 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 109.15 -0.685 . . . . 13.83 109.15 178.563 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.15 28.61 0.36 Allowed 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 122.65 2.233 . . . . 15.34 113.288 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -98.7 -64.69 1.01 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.145 0.498 . . . . 16.89 110.001 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.449 ' HB2' ' HG3' ' A' ' 102' ' ' GLU . 49.5 m -133.24 17.98 4.06 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.686 -0.688 . . . . 14.89 109.648 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.9 t70 63.62 34.16 12.62 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.272 -0.877 . . . . 14.77 109.811 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.449 ' HG3' ' HB2' ' A' ' 100' ' ' SER . 0.1 OUTLIER -80.3 130.22 35.04 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.181 -0.918 . . . . 12.95 110.154 -179.796 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.41 HG12 ' HG3' ' A' ' 96' ' ' GLN . 36.7 mt -81.15 106.74 12.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.872 -0.418 . . . . 11.11 109.872 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -70.58 -43.81 68.65 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.728 0.299 . . . . 11.65 110.328 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.407 ' HB2' ' O ' ' A' ' 16' ' ' HIS . 31.6 p90 -165.5 172.4 12.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.211 -0.449 . . . . 10.3 110.295 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 52.1 mt -110.86 122.76 65.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.106 -0.497 . . . . 10.29 110.529 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.51 HG23 HG23 ' A' ' 13' ' ' ILE . 87.4 mt -84.56 110.72 19.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.311 -0.626 . . . . 8.99 109.311 179.163 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.598 ' HB3' HG23 ' A' ' 90' ' ' THR . 64.5 m -110.79 109.37 19.56 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.143 0.497 . . . . 9.83 111.505 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.722 HG21 HG13 ' B' ' 13' ' ' ILE . 22.5 m -83.78 100.01 10.65 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.823 -0.806 . . . . 10.84 108.823 178.608 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.437 ' HB3' ' SD ' ' A' ' 88' ' ' MET . 6.0 m-20 -84.68 101.57 12.28 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.989 -0.55 . . . . 11.26 111.549 -178.373 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.44 HG23 ' HB2' ' A' ' 11' ' ' GLU . 2.5 m -103.87 121.1 42.37 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.98 -0.555 . . . . 11.22 109.791 178.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ASN . . . . . 0.716 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 4.3 t30 -75.87 125.26 28.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.939 0.4 . . . . 12.78 110.826 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 61.7 t -98.55 -49.47 11.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.728 -0.669 . . . . 14.64 109.929 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.538 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 52.1 mtpt . . . . . 0 C--O 1.252 1.194 0 CA-C-O 118.483 -0.77 . . . . 16.02 110.388 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 72.4 m . . . . . 0 N--CA 1.477 0.88 0 CA-C-O 120.871 0.367 . . . . 7.49 110.23 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 8' ' ' GLN . . . . . 0.55 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 71.6 mm-40 -95.08 142.3 24.42 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.026 -0.534 . . . . 7.12 110.997 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 9' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' B' ' 8' ' ' GLN . 10.8 Cg_exo -72.87 171.99 16.29 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 123.099 2.533 . . . . 6.18 111.757 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.91 56.48 3.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.312 0.577 . . . . 5.81 111.082 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.66 ' HA ' ' O ' ' B' ' 110' ' ' ASN . 0.0 OUTLIER -162.85 141.74 8.69 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.399 -0.963 . . . . 5.85 108.399 179.722 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -152.47 165.73 34.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.334 0.588 . . . . 6.08 112.274 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.722 HG13 HG21 ' A' ' 109' ' ' THR . 9.1 mm -90.57 118.07 35.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 114.857 -1.065 . . . . 5.57 110.329 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.665 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.7 OUTLIER -106.31 94.49 5.18 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.773 -0.649 . . . . 5.3 110.293 179.639 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 15' ' ' ARG . . . . . 0.562 ' HG2' HG12 ' B' ' 107' ' ' ILE . 55.8 mtp180 -87.58 101.89 14.06 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.273 -0.64 . . . . 8.97 109.273 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 16' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' B' ' 105' ' ' TYR . 35.0 p80 -132.21 162.07 31.85 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.132 -0.486 . . . . 8.31 110.551 -179.064 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -83.17 177.91 8.34 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.517 -0.311 . . . . 10.83 110.291 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 26.6 pt -60.91 -20.88 22.8 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 113.24 0.83 . . . . 8.89 113.24 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -83.69 -14.42 51.8 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.196 0.522 . . . . 11.92 110.601 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 104.14 -6.34 46.72 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.486 -0.864 . . . . 8.57 111.901 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' ILE . . . . . 0.542 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 26.9 mm -70.03 117.21 12.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 110.021 -0.362 . . . . 10.87 110.021 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 22' ' ' PHE . . . . . 0.665 ' HE1' ' HB3' ' B' ' 14' ' ' SER . 97.0 m-85 -73.4 133.07 43.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.201 0.524 . . . . 8.23 111.829 -179.307 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -103.89 -35.3 8.2 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.479 -0.782 . . . . 7.91 110.018 178.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -148.04 129.55 14.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.794 -0.639 . . . . 7.89 110.246 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 25' ' ' VAL . . . . . 0.568 HG21 ' HB2' ' B' ' 40' ' ' LEU . 12.4 t -124.23 126.49 72.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.479 -0.563 . . . . 6.1 109.479 179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -67.76 156.06 37.86 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.975 0.416 . . . . 7.15 110.765 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -62.59 -19.21 63.51 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.842 -0.617 . . . . 8.97 112.2 -178.054 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 28' ' ' ARG . . . . . 0.55 ' HG2' ' HB3' ' B' ' 8' ' ' GLN . 70.3 mtm180 -64.78 -16.73 63.42 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.839 0.311 . . . . 9.76 111.839 -179.8 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 30.3 p -60.77 -32.62 71.93 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 120.872 0.368 . . . . 11.56 111.099 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 18.1 t -64.51 -36.22 76.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 13.64 111.076 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.49 -19.13 31.67 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.985 0.422 . . . . 12.9 110.811 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 20.1 m -84.52 -57.93 2.94 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.152 -0.476 . . . . 12.13 111.889 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 33' ' ' VAL . . . . . 0.464 HG11 ' HD2' ' B' ' 78' ' ' PHE . 6.2 m -122.24 -5.01 8.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 N-CA-C 112.373 0.509 . . . . 13.87 112.373 -178.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.86 -18.21 36.51 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.471 -0.871 . . . . 13.79 112.962 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -67.05 136.96 56.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.734 0.302 . . . . 15.38 110.919 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 36' ' ' GLN . . . . . 0.633 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 13.8 mm100 -80.57 151.65 71.83 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 109.144 -0.687 . . . . 13.78 109.144 178.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.516 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 74.5 Cg_exo -50.61 -44.31 40.95 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.845 2.363 . . . . 14.71 112.864 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -65.11 -24.95 67.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.079 -0.509 . . . . 17.54 112.164 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.633 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 30.6 mt-10 -69.19 -25.82 64.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.805 0.336 . . . . 14.24 111.061 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.568 ' HB2' HG21 ' B' ' 25' ' ' VAL . 2.2 mm? -94.84 -21.27 18.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.226 -0.443 . . . . 14.03 110.873 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 52.5 mt -61.87 119.24 8.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.217 -0.447 . . . . 13.62 110.826 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 82.14 10.07 84.29 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.862 -0.685 . . . . 11.62 112.511 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.687 ' HE2' ' HA ' ' B' ' 43' ' ' LYS . 8.7 mmpt? -117.0 156.24 27.82 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 110.153 -0.314 . . . . 13.82 110.153 179.761 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 44' ' ' ASN . . . . . 0.731 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 13.5 m120 -93.29 135.93 34.04 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.153 -0.476 . . . . 10.16 109.91 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 45' ' ' ILE . . . . . 0.42 ' HB ' ' CZ ' ' B' ' 22' ' ' PHE . 15.4 tt -59.71 -26.27 34.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.285 0.564 . . . . 9.62 110.847 178.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 46' ' ' VAL . . . . . 0.401 HG12 ' HB3' ' B' ' 44' ' ' ASN . 9.8 p -71.17 -22.05 22.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.844 -0.616 . . . . 11.5 111.243 -179.707 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 47' ' ' GLU . . . . . 0.731 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 44.2 mt-10 -70.63 -30.04 66.58 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.968 0.413 . . . . 11.89 110.668 -179.596 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 48' ' ' PHE . . . . . 0.416 ' HE1' ' HB3' ' B' ' 43' ' ' LYS . 40.4 m-85 -105.37 21.06 17.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.933 -0.576 . . . . 13.6 110.447 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 53.4 t -104.52 151.98 22.93 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 116.004 -0.544 . . . . 10.81 110.411 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 50' ' ' HIS . . . . . 0.432 ' CD2' ' HD2' ' B' ' 51' ' ' PRO . 10.4 t-80 -61.61 126.54 87.03 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.817 -0.629 . . . . 11.49 109.542 178.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 51' ' ' PRO . . . . . 0.432 ' HD2' ' CD2' ' B' ' 50' ' ' HIS . 76.0 Cg_exo -42.55 -50.32 5.85 Favored 'Trans proline' 0 CA--C 1.533 0.439 0 C-N-CA 123.62 2.88 . . . . 11.35 114.143 -179.354 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -75.98 2.98 11.19 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.649 0.611 . . . . 9.28 112.649 -179.071 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -126.27 3.26 7.07 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.997 0.427 . . . . 7.52 110.841 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -67.6 -37.55 82.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.822 -0.626 . . . . 6.57 110.692 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 47.8 tp60 -65.86 -40.84 92.07 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.994 -0.743 . . . . 6.58 108.994 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.513 HD23 ' HB3' ' B' ' 76' ' ' PHE . 32.1 tp -57.2 -45.07 84.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.132 -0.94 . . . . 4.6 110.713 178.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.453 ' HA ' HD23 ' B' ' 57' ' ' LEU . 1.0 OUTLIER -61.02 -50.33 73.78 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.053 -0.521 . . . . 6.4 110.739 179.645 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 55.3 ttt180 -59.82 -45.39 92.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.783 -0.644 . . . . 8.18 110.925 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -62.0 -45.32 94.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.926 -0.579 . . . . 6.07 110.985 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 23.4 m -63.33 -37.85 88.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.219 -0.446 . . . . 5.59 110.684 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 61' ' ' PHE . . . . . 0.504 ' O ' HG12 ' B' ' 64' ' ' VAL . 4.3 m-30 -65.08 -41.0 95.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.379 -0.373 . . . . 7.73 110.411 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 87.4 mm-40 -63.9 -39.02 93.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.98 0.419 . . . . 6.89 110.273 179.184 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.438 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 39.2 mt-30 -69.11 -40.48 78.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.976 -0.556 . . . . 9.4 111.792 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.504 HG12 ' O ' ' B' ' 61' ' ' PHE . 4.0 p -67.19 -25.39 33.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-O 120.767 0.317 . . . . 7.57 111.11 -179.278 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 65' ' ' VAL . . . . . 0.508 ' HA ' HG21 ' B' ' 94' ' ' THR . 51.7 t -69.21 -35.83 69.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 109.263 -0.643 . . . . 7.43 109.263 178.594 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -70.48 -36.06 73.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.511 -0.768 . . . . 10.21 110.093 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' B' ' 63' ' ' GLN . 69.8 mt -65.56 -43.86 88.52 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.119 -0.697 . . . . 7.2 109.119 178.654 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 65.9 tttt 47.29 90.57 0.02 OUTLIER 'General case' 0 C--O 1.235 0.298 0 CA-C-N 114.801 -1.09 . . . . 7.58 112.837 178.425 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 108.6 1.59 32.67 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.552 -0.832 . . . . 5.57 112.334 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -114.94 165.34 12.97 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.986 -0.376 . . . . 5.43 109.986 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 6.6 t -108.14 127.13 64.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.067 0.461 . . . . 5.65 111.118 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 42.0 tp -119.52 103.11 9.14 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.567 -0.742 . . . . 4.51 109.062 178.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 73' ' ' SER . . . . . 0.575 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.3 p -86.64 112.59 21.76 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.046 -0.525 . . . . 6.35 111.228 -179.412 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 p -107.04 127.16 62.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.704 -0.68 . . . . 4.34 109.927 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 28.7 ttt -100.54 110.33 22.49 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.08 0.467 . . . . 5.42 110.815 -179.476 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.513 ' HB3' HD23 ' B' ' 56' ' ' LEU . 51.9 p90 -137.14 -173.16 3.38 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.729 -0.669 . . . . 3.54 109.368 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 77' ' ' ARG . . . . . 0.483 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 50.6 mtm180 -105.15 119.48 39.16 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.148 0.499 . . . . 6.8 110.507 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.464 ' HD2' HG11 ' B' ' 33' ' ' VAL . 16.8 t80 -102.49 148.84 25.03 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.2 -0.909 . . . . 5.79 110.339 -179.184 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 79' ' ' ARG . . . . . 0.649 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 3.6 ttp180 -90.06 124.27 34.64 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.205 -0.452 . . . . 11.08 110.185 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 80' ' ' SER . . . . . 0.499 ' HB3' HD21 ' B' ' 86' ' ' LEU . 95.0 p -91.52 -175.23 4.14 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.579 -0.526 . . . . 7.47 109.579 178.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -65.16 -16.6 63.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.113 0.482 . . . . 12.24 110.479 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -89.23 -0.22 57.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.13 -0.486 . . . . 9.25 110.458 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 69.16 12.59 8.53 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.7 -0.682 . . . . 8.3 111.678 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -89.96 154.85 19.53 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.937 -0.394 . . . . 6.78 109.937 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 85' ' ' TRP . . . . . 0.649 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 57.2 m95 -97.86 108.48 21.2 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.31 -0.405 . . . . 7.89 111.371 -178.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.499 HD21 ' HB3' ' B' ' 80' ' ' SER . 1.9 pp -109.31 147.52 32.54 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.071 -0.513 . . . . 6.97 110.176 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 87' ' ' TRP . . . . . 0.764 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 87.3 m95 -77.74 118.66 20.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.106 0.479 . . . . 8.55 110.231 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 7.3 tpp -123.32 135.07 54.02 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.589 -0.732 . . . . 4.46 111.319 -178.487 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 37.5 ttp180 -96.17 89.55 5.18 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.633 -0.877 . . . . 6.87 108.633 178.208 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 90' ' ' THR . . . . . 0.687 HG23 ' HB3' ' B' ' 108' ' ' CYS . 27.4 m -78.29 104.01 8.6 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.867 -0.606 . . . . 6.18 111.111 -179.304 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 91' ' ' SER . . . . . 0.588 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 1.8 m -85.63 91.0 8.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.875 -0.602 . . . . 6.3 109.707 179.57 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 9.3 m -78.53 122.22 25.6 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.814 -0.63 . . . . 6.65 111.58 -178.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -122.09 121.74 37.64 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.095 -0.502 . . . . 6.45 110.082 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 94' ' ' THR . . . . . 0.508 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.1 OUTLIER -82.23 110.25 17.25 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.449 -0.341 . . . . 9.17 110.395 179.483 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.68 126.51 30.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.138 0.494 . . . . 8.33 110.552 -179.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -96.26 119.05 34.03 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.555 -0.748 . . . . 10.53 110.446 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 97' ' ' ASN . . . . . 0.418 ' HB3' ' OE1' ' B' ' 102' ' ' GLU . 52.3 t30 -68.44 126.04 92.29 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.184 -0.673 . . . . 8.43 109.184 178.628 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.48 4.5 2.46 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 123.095 2.53 . . . . 9.16 114.084 -178.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -86.34 -70.56 0.6 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.843 0.354 . . . . 11.34 111.483 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -129.85 27.07 5.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.604 -0.271 . . . . 7.75 111.039 -179.496 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 33.8 t70 60.36 49.29 7.09 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.585 0.707 . . . . 9.08 110.215 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 102' ' ' GLU . . . . . 0.418 ' OE1' ' HB3' ' B' ' 97' ' ' ASN . 3.3 mp0 -97.8 153.92 17.97 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.876 -0.602 . . . . 7.71 110.123 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 46.0 mt -95.84 96.17 5.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 109.506 -0.553 . . . . 8.04 109.506 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -68.02 -47.83 67.37 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.995 -0.548 . . . . 8.81 110.819 -179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 105' ' ' TYR . . . . . 0.44 ' HB2' ' O ' ' B' ' 16' ' ' HIS . 8.8 p90 -167.93 178.39 5.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.406 -0.361 . . . . 7.4 110.41 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 54.0 mt -120.44 115.96 48.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.89 -0.596 . . . . 6.78 110.093 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.562 HG12 ' HG2' ' B' ' 15' ' ' ARG . 19.7 mt -91.25 119.67 38.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 109.36 -0.608 . . . . 6.31 109.36 179.463 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 108' ' ' CYS . . . . . 0.687 ' HB3' HG23 ' B' ' 90' ' ' THR . 71.4 m -111.43 117.88 34.28 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.909 0.385 . . . . 5.31 111.812 -179.329 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 109' ' ' THR . . . . . 0.588 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 28.9 m -81.54 97.75 7.97 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.965 -1.124 . . . . 5.48 107.965 177.209 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 110' ' ' ASN . . . . . 0.66 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.5 m-20 -79.39 102.1 8.5 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.708 -0.678 . . . . 6.9 110.906 -178.427 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.04 113.25 26.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.261 -0.427 . . . . 8.61 110.61 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -68.89 132.42 46.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.82 0.343 . . . . 11.84 110.558 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 113' ' ' VAL . . . . . 0.414 HG12 ' HG3' ' B' ' 114' ' ' LYS . 52.7 t -111.8 -46.18 5.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.987 -0.552 . . . . 11.77 110.239 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 114' ' ' LYS . . . . . 0.764 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 59.4 mtpt . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.568 -0.729 . . . . 12.68 109.927 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.534 ' HB2' ' CB ' ' A' ' 31' ' ' ALA . 49.8 mm-40 . . . . . 0 N--CA 1.454 -0.229 0 N-CA-C 110.032 -0.359 . . . . 15.08 110.032 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.31 170.99 18.91 Favored 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 122.545 2.163 . . . . 13.43 112.332 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.604 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.1 OUTLIER -84.15 50.83 1.93 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.031 -0.531 . . . . 11.09 111.13 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.514 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 3.6 tm-20 -153.61 137.88 16.59 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.591 -0.731 . . . . 10.59 109.036 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.877 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 26.9 p90 -153.22 142.96 21.99 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.091 0.472 . . . . 8.93 110.874 179.534 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 50.3 mm -82.02 120.57 33.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.795 -0.639 . . . . 8.66 111.083 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.773 ' HB3' ' HE1' ' A' ' 22' ' ' PHE . 1.6 m -103.2 94.24 5.42 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.907 -0.588 . . . . 6.11 110.551 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.604 ' HD3' ' HB3' ' A' ' 24' ' ' PHE . 10.5 mtp180 -85.73 97.25 10.04 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.411 -0.588 . . . . 9.09 109.411 179.502 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 30.9 p80 -127.66 154.28 45.47 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.682 -0.69 . . . . 9.79 110.251 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.6 p-10 -73.61 178.18 4.89 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.525 -0.307 . . . . 12.69 110.427 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.6 pt -56.63 -28.95 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 112.815 0.672 . . . . 13.58 112.815 -179.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -77.57 -17.2 58.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.892 0.377 . . . . 13.85 111.399 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 105.79 -3.22 38.9 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.596 -0.811 . . . . 9.38 112.687 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.501 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 18.2 mm -71.62 117.15 14.51 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-O 120.764 0.316 . . . . 10.74 110.687 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.773 ' HE1' ' HB3' ' A' ' 14' ' ' SER . 98.6 m-85 -69.89 125.33 26.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.131 -0.486 . . . . 9.73 110.324 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 m -109.42 -21.55 12.45 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.358 0.599 . . . . 7.74 109.96 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.604 ' HB3' ' HD3' ' A' ' 15' ' ' ARG . 23.7 t80 -151.86 116.43 5.09 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.882 -0.784 . . . . 6.92 108.882 178.544 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.629 HG21 ' HB2' ' A' ' 40' ' ' LEU . 3.0 t -109.94 153.1 11.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-O 120.854 0.359 . . . . 6.02 110.917 -178.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.877 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 5.0 t70 -72.0 172.54 9.84 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.91 -0.587 . . . . 7.31 110.358 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -96.83 -25.01 15.62 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.319 0.58 . . . . 11.67 109.817 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 54.3 mtm180 -76.11 -4.34 40.99 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.485 -0.779 . . . . 11.91 112.371 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.9 p -59.25 -27.71 66.05 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 120.843 0.354 . . . . 12.99 111.544 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.432 ' O ' ' HA2' ' A' ' 34' ' ' GLY . 24.4 t -62.57 -34.94 67.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.98 -0.555 . . . . 16.15 110.923 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.534 ' CB ' ' HB2' ' A' ' 8' ' ' GLN . . . -93.48 -6.28 47.25 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.875 0.369 . . . . 15.07 111.011 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.8 m -90.99 -55.55 3.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.996 0.427 . . . . 14.9 110.304 179.131 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.541 HG11 ' HD2' ' A' ' 78' ' ' PHE . 3.7 m -123.56 -21.25 3.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.905 -0.589 . . . . 13.84 111.42 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.432 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 101.73 -17.49 54.71 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.391 -0.909 . . . . 13.85 112.147 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.466 ' H ' HG23 ' A' ' 33' ' ' VAL . 7.3 m-85 -71.41 137.2 48.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.806 0.336 . . . . 18.28 110.554 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -79.25 152.23 76.08 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.197 -0.668 . . . . 15.48 109.197 179.026 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.519 ' HB3' ' HB ' ' A' ' 25' ' ' VAL . 50.8 Cg_exo -53.89 -38.65 86.06 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.454 2.103 . . . . 11.63 112.168 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.42 ' HA ' HD12 ' A' ' 41' ' ' LEU . 26.2 mp0 -68.48 -16.61 63.95 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.833 -0.621 . . . . 13.31 111.624 -179.386 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.17 -23.48 35.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.991 0.424 . . . . 17.34 109.909 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.629 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.6 mm? -92.67 -32.24 14.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.874 -0.603 . . . . 13.25 110.288 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 86.8 mt -54.92 119.15 4.98 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.091 -0.504 . . . . 12.99 111.496 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.47 4.97 85.35 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.855 -0.688 . . . . 13.39 112.984 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.636 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 7.7 mmpt? -114.78 157.93 22.57 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 122.556 -0.379 . . . . 16.87 110.556 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.696 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 16.1 m120 -92.4 134.19 35.17 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.672 -0.492 . . . . 12.5 109.672 179.454 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.48 HD13 ' HZ ' ' A' ' 61' ' ' PHE . 11.3 tt -56.63 -30.39 31.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.991 0.424 . . . . 11.72 111.452 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.8 p -70.53 -17.94 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-N 116.247 -0.433 . . . . 12.89 111.753 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.696 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.2 mt-10 -72.48 -34.21 67.53 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.958 0.408 . . . . 16.53 110.431 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.456 ' HE1' ' HB3' ' A' ' 43' ' ' LYS . 68.3 m-85 -99.87 21.16 13.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.807 -0.633 . . . . 15.34 110.299 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 13.2 t -108.06 150.49 27.09 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.781 -0.645 . . . . 11.97 110.733 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.532 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 0.8 OUTLIER -56.09 128.17 71.23 Favored Pre-proline 0 C--N 1.333 -0.139 0 N-CA-C 109.019 -0.734 . . . . 14.67 109.019 178.612 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo -50.37 -40.91 52.82 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 122.777 2.318 . . . . 15.15 112.828 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -75.51 -14.55 60.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.484 -0.326 . . . . 16.47 111.36 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.532 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 34.5 m-20 -103.39 -6.63 21.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.605 -0.27 . . . . 13.16 111.203 -179.507 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -56.59 -42.56 78.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 15.83 111.344 -179.251 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 49.0 tp60 -64.68 -45.28 87.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.43 -0.35 . . . . 13.94 110.425 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.9 tp -59.55 -42.44 92.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.998 -0.546 . . . . 12.11 110.505 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.494 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.5 OUTLIER -63.16 -54.5 36.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.081 -0.509 . . . . 9.71 110.617 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 56.4 ttt180 -58.53 -41.02 84.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.08 -0.509 . . . . 11.06 110.919 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.38 -43.33 96.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.958 -0.564 . . . . 9.71 110.579 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.6 m -70.19 -32.58 70.57 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.791 -0.64 . . . . 9.52 111.148 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.548 ' O ' HG12 ' A' ' 64' ' ' VAL . 8.3 m-85 -62.09 -50.39 72.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.948 0.404 . . . . 11.4 110.488 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -67.86 -30.77 70.23 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.707 -0.479 . . . . 10.04 109.707 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -63.17 -45.32 92.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.633 -0.712 . . . . 10.6 110.915 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.548 HG12 ' O ' ' A' ' 61' ' ' PHE . 1.9 p -67.2 -24.1 31.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-O 120.813 0.34 . . . . 10.62 110.576 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.467 ' O ' ' HG3' ' A' ' 68' ' ' LYS . 69.3 t -72.43 -38.93 61.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 108.963 -0.754 . . . . 12.41 108.963 178.37 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 42.1 mtpt -73.46 -30.36 63.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.377 -0.829 . . . . 16.25 109.766 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 22.0 mt -68.36 -57.45 5.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.558 -0.747 . . . . 12.66 110.33 179.031 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 65' ' ' VAL . 67.7 mttt 62.97 83.47 0.16 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.685 -0.689 . . . . 14.83 112.175 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.51 -47.72 1.0 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.579 -0.82 . . . . 9.8 113.127 178.707 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -71.6 136.22 47.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.944 0.402 . . . . 9.59 110.599 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.522 ' HB ' ' HZ ' ' B' ' 24' ' ' PHE . 4.1 p -80.44 123.94 37.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.611 -0.722 . . . . 8.1 110.229 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 25.2 tp -107.14 109.56 21.42 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.067 0.461 . . . . 7.8 110.569 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.428 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 1.3 m -89.56 109.04 20.02 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.796 -0.638 . . . . 7.59 110.923 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 p -103.8 129.71 55.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.403 -0.362 . . . . 7.84 110.082 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 26.2 ttt -104.28 115.08 29.76 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.096 0.474 . . . . 9.35 110.433 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.565 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 31.6 p90 -145.86 178.58 8.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.797 -0.638 . . . . 9.66 109.975 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.806 ' HB3' ' HB3' ' A' ' 85' ' ' TRP . 9.0 mtt180 -98.14 116.51 30.51 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.836 0.35 . . . . 13.1 110.472 179.256 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.565 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 19.4 t80 -100.95 147.29 26.33 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.107 -0.497 . . . . 9.28 109.897 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.424 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 37.9 ttp180 -81.91 132.59 35.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.858 0.361 . . . . 10.87 111.001 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.469 ' HA ' ' HB ' ' A' ' 33' ' ' VAL . 54.6 p -95.94 -176.69 3.78 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.078 -0.51 . . . . 10.77 110.108 179.142 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.5 tptt -69.64 -18.74 63.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.344 0.592 . . . . 12.66 109.614 178.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 -91.38 5.33 49.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.634 -0.712 . . . . 14.42 109.685 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 65.51 23.71 11.83 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.115 -0.948 . . . . 12.69 111.659 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -98.71 164.89 12.05 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.123 -0.695 . . . . 10.85 109.123 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.806 ' HB3' ' HB3' ' A' ' 77' ' ' ARG . 55.2 m95 -109.61 112.63 24.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.133 0.492 . . . . 11.2 111.29 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.485 HD21 HG12 ' A' ' 33' ' ' VAL . 1.3 pp -108.66 150.31 27.72 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.77 -0.65 . . . . 11.12 110.17 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -76.34 116.35 16.94 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.019 0.437 . . . . 10.28 110.487 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 18.2 tpp -116.86 129.05 55.83 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.75 -0.659 . . . . 9.32 110.718 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.3 ttp180 -100.66 77.4 1.89 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.471 -0.937 . . . . 10.66 108.471 178.521 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.412 HG23 ' HB3' ' A' ' 108' ' ' CYS . 61.2 m -69.54 108.37 3.78 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.353 -0.84 . . . . 9.37 113.033 -177.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.449 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 1.5 m -86.78 95.1 9.72 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.947 -0.76 . . . . 8.27 108.947 177.675 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.3 m -83.63 130.71 34.98 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.005 0.372 . . . . 8.65 112.005 -178.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -124.58 129.07 49.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.714 -0.675 . . . . 11.56 110.057 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.38 115.23 15.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.29 -0.414 . . . . 10.16 111.001 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -89.99 106.18 18.3 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.968 0.413 . . . . 12.25 110.314 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.616 ' HG2' HG12 ' A' ' 103' ' ' ILE . 16.6 mt-30 -114.8 156.93 23.98 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.776 -0.647 . . . . 14.24 110.689 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.433 ' HB2' ' OE2' ' A' ' 102' ' ' GLU . 92.1 m-20 -95.2 149.09 35.7 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 109.096 -0.705 . . . . 13.83 109.096 178.632 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -83.15 18.42 1.5 Allowed 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 122.581 2.187 . . . . 15.34 112.58 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -97.71 -66.57 0.89 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.369 -0.378 . . . . 16.89 110.903 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.4 m -126.01 20.28 7.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.459 -0.337 . . . . 14.89 110.522 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.7 t70 60.41 33.51 20.7 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.715 -0.675 . . . . 14.77 110.94 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.433 ' OE2' ' HB2' ' A' ' 97' ' ' ASN . 0.5 OUTLIER -78.05 136.9 38.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.936 -0.575 . . . . 12.95 110.154 -179.826 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.616 HG12 ' HG2' ' A' ' 96' ' ' GLN . 45.8 mt -94.0 114.19 30.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.84 -0.43 . . . . 11.11 109.84 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -77.32 -53.56 7.55 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.828 0.347 . . . . 11.65 110.78 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 15.4 p90 -158.17 -178.27 7.17 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.271 -0.422 . . . . 10.3 110.525 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 24.4 mt -113.34 116.16 51.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.96 -0.564 . . . . 10.29 110.072 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 59.3 mt -83.21 100.1 6.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.14 -0.482 . . . . 8.99 109.875 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.432 ' HB2' ' HB2' ' A' ' 14' ' ' SER . 51.8 m -94.68 114.71 26.67 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.243 -0.435 . . . . 9.83 111.33 -179.582 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.449 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 4.0 m -87.51 93.02 9.29 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.912 -0.773 . . . . 10.84 108.912 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.514 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 6.2 m-20 -78.3 99.23 6.22 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.849 -0.614 . . . . 11.26 112.019 -178.171 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.796 HG21 HH12 ' B' ' 28' ' ' ARG . 0.7 OUTLIER -107.22 117.74 34.87 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.883 -0.414 . . . . 11.22 109.883 178.306 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ASN . . . . . 0.604 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 8.5 t-20 -76.53 130.13 37.47 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.016 0.436 . . . . 12.78 110.975 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 28.9 t -104.77 -54.79 6.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 115.622 -0.717 . . . . 14.64 109.576 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 46.7 mtpt . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.141 -0.933 . . . . 16.02 110.006 -179.656 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 77.2 m . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 110.173 -0.306 . . . . 7.49 110.173 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -120.72 151.5 54.51 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 116.565 -0.289 . . . . 7.12 110.224 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -66.06 161.13 41.24 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.751 2.3 . . . . 6.18 112.664 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 10' ' ' THR . . . . . 0.475 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.3 OUTLIER -82.09 59.81 4.59 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.834 -0.621 . . . . 5.81 111.364 -179.499 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.525 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -156.38 153.28 28.69 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.811 -0.811 . . . . 5.85 108.811 179.184 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -158.83 158.54 33.68 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.137 0.494 . . . . 6.08 111.358 179.698 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.583 ' HB ' ' HB2' ' B' ' 26' ' ' ASP . 21.5 mm -93.35 117.05 35.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.541 -0.754 . . . . 5.57 110.09 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.672 ' HB3' ' HE2' ' B' ' 22' ' ' PHE . 0.6 OUTLIER -107.32 96.31 6.32 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.094 -0.503 . . . . 5.3 111.303 -179.084 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 15' ' ' ARG . . . . . 0.666 ' HD3' ' HB3' ' B' ' 24' ' ' PHE . 23.5 mtp85 -90.66 107.7 19.34 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.908 -0.775 . . . . 8.97 108.908 179.046 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 16' ' ' HIS . . . . . 0.468 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 31.3 p80 -136.98 165.55 25.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.63 -0.259 . . . . 8.31 111.45 -178.643 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -77.94 177.33 8.34 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 116.038 -0.528 . . . . 10.83 110.245 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 22.8 pt -58.11 -30.48 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 N-CA-C 112.917 0.71 . . . . 8.89 112.917 -178.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -78.63 -16.85 56.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.08 0.467 . . . . 11.92 111.495 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 108.16 -1.12 33.25 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.432 -0.89 . . . . 8.57 112.359 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 21' ' ' ILE . . . . . 0.508 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 33.1 mm -69.56 111.87 3.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 N-CA-C 109.805 -0.443 . . . . 10.87 109.805 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 22' ' ' PHE . . . . . 0.672 ' HE2' ' HB3' ' B' ' 14' ' ' SER . 57.1 m-85 -63.57 126.72 28.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.248 -0.433 . . . . 8.23 110.972 -179.467 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 1.4 m -100.64 -33.37 10.32 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.957 -0.565 . . . . 7.91 110.237 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 24' ' ' PHE . . . . . 0.666 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 32.3 t80 -156.62 127.33 6.72 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.693 -0.685 . . . . 7.89 109.437 179.561 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 15.0 t -115.02 138.3 45.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.434 -0.348 . . . . 6.1 110.672 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 26' ' ' ASP . . . . . 0.583 ' HB2' ' HB ' ' B' ' 13' ' ' ILE . 9.6 t70 -75.02 141.65 43.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.058 -0.519 . . . . 7.15 109.698 179.173 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 18.4 m170 -70.4 87.54 0.63 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.05 0.453 . . . . 8.97 110.185 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 28' ' ' ARG . . . . . 0.796 HH12 HG21 ' A' ' 111' ' ' THR . 12.5 mtm180 -169.53 -21.57 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.022 -0.99 . . . . 9.76 110.408 -179.377 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 29' ' ' CYS . . . . . 0.419 ' H ' ' H ' ' B' ' 28' ' ' ARG . 24.3 p -55.86 -30.53 61.65 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.601 0.593 . . . . 11.56 112.601 -178.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.4 ' O ' ' HA2' ' B' ' 34' ' ' GLY . 3.2 t -68.36 -21.84 26.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.138 0.494 . . . . 13.64 110.782 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -96.25 -19.49 19.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.151 -0.477 . . . . 12.9 110.039 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 2.5 m -85.61 -60.02 2.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.978 -0.555 . . . . 12.13 111.303 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 33' ' ' VAL . . . . . 0.523 HG11 ' HD2' ' B' ' 78' ' ' PHE . 3.5 m -116.58 -14.52 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.808 0.337 . . . . 13.87 111.586 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 34' ' ' GLY . . . . . 0.4 ' HA2' ' O ' ' B' ' 30' ' ' VAL . . . 91.82 -2.96 77.27 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.503 -0.856 . . . . 13.79 112.817 179.379 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 35' ' ' TYR . . . . . 0.443 ' H ' HG23 ' B' ' 33' ' ' VAL . 5.4 m-85 -82.32 137.8 34.7 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.716 0.293 . . . . 15.38 110.62 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 36' ' ' GLN . . . . . 0.827 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 77.5 mm-40 -73.21 146.75 87.27 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 116.092 -0.504 . . . . 13.78 109.769 179.114 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.566 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 51.1 Cg_exo -53.89 -39.76 83.28 Favored 'Trans proline' 0 CA--C 1.529 0.27 0 C-N-CA 122.38 2.053 . . . . 14.71 112.125 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -69.34 -14.52 62.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.849 -0.614 . . . . 17.54 111.864 -179.563 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.827 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 29.3 mt-10 -82.72 -21.07 34.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.94 0.4 . . . . 14.24 110.368 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.46 ' HB3' ' CG ' ' B' ' 22' ' ' PHE . 1.2 mm? -94.57 -28.5 15.37 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.802 -0.635 . . . . 14.03 110.016 179.201 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 87.1 mt -62.71 119.21 8.84 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.986 -0.552 . . . . 13.62 110.692 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 90.24 -2.98 81.97 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.911 -0.661 . . . . 11.62 112.097 -179.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.508 ' O ' ' HA ' ' B' ' 21' ' ' ILE . 1.5 mmpt? -109.14 161.66 15.0 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.681 0.277 . . . . 13.82 110.29 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 44' ' ' ASN . . . . . 0.788 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 15.4 m120 -96.63 135.24 38.81 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.484 -0.562 . . . . 10.16 109.484 179.626 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.1 tt -60.68 -22.65 26.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.224 0.535 . . . . 9.62 110.75 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 46' ' ' VAL . . . . . 0.4 HG12 ' HB3' ' B' ' 44' ' ' ASN . 9.9 p -74.59 -18.19 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 116.052 -0.522 . . . . 11.5 111.196 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 47' ' ' GLU . . . . . 0.788 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 36.5 mt-10 -73.85 -38.25 64.55 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.959 0.409 . . . . 11.89 110.877 -179.526 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 48' ' ' PHE . . . . . 0.506 ' HB2' ' CZ ' ' B' ' 78' ' ' PHE . 25.4 m-85 -96.34 18.28 14.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.018 -0.537 . . . . 13.6 110.575 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 51.9 t -103.11 149.56 24.49 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.071 -0.513 . . . . 10.81 110.647 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 50' ' ' HIS . . . . . 0.668 ' HB3' ' HB2' ' B' ' 53' ' ' ASP . 9.3 t-160 -57.19 127.63 76.7 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.663 -0.699 . . . . 11.49 109.17 178.46 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_exo -45.06 -50.8 8.37 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.083 2.522 . . . . 11.35 113.438 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 13.5 mp0 -75.08 4.15 7.26 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.447 0.536 . . . . 9.28 112.447 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 53' ' ' ASP . . . . . 0.668 ' HB2' ' HB3' ' B' ' 50' ' ' HIS . 6.0 m-20 -122.46 -0.22 9.3 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.108 0.48 . . . . 7.52 110.341 179.387 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -66.69 -38.37 86.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.802 -0.635 . . . . 6.57 110.794 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 48.1 tp60 -65.65 -45.21 83.84 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.682 -0.488 . . . . 6.58 109.682 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 40.7 tp -58.77 -42.49 89.07 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.482 -0.781 . . . . 4.6 110.573 179.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.517 ' HA ' HD23 ' B' ' 57' ' ' LEU . 1.1 mt -63.02 -54.55 36.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.032 -0.531 . . . . 6.4 110.777 179.61 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 42.2 ttt180 -58.36 -43.63 88.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 8.18 111.059 -179.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -60.14 -46.04 91.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.042 -0.526 . . . . 6.07 110.645 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 42.5 m -63.92 -39.02 93.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.069 -0.514 . . . . 5.59 110.726 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 61' ' ' PHE . . . . . 0.457 ' O ' HG12 ' B' ' 64' ' ' VAL . 9.7 m-85 -62.95 -44.13 96.91 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.829 0.347 . . . . 7.73 110.287 179.392 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -66.93 -35.0 79.0 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.309 -0.405 . . . . 6.89 110.375 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.407 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 27.2 mt-30 -69.92 -40.76 75.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.109 -0.496 . . . . 9.4 111.593 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.457 ' HA ' HD12 ' B' ' 67' ' ' LEU . 9.8 p -70.02 -25.96 28.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 120.917 0.389 . . . . 7.57 110.832 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 65' ' ' VAL . . . . . 0.625 ' HA ' HG21 ' B' ' 94' ' ' THR . 24.6 t -68.44 -32.81 56.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.389 0.614 . . . . 7.43 109.407 178.609 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -78.53 -11.49 59.96 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.475 -0.784 . . . . 10.21 110.85 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.624 ' HB3' ' HB2' ' B' ' 70' ' ' GLN . 96.8 mt -82.7 -55.7 4.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.128 -0.487 . . . . 7.2 109.996 179.58 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 79.8 mttt 66.18 111.22 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.492 -0.777 . . . . 7.58 111.702 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 69' ' ' GLY . . . . . 0.433 ' HA3' ' OE1' ' B' ' 96' ' ' GLN . . . 75.98 19.54 78.63 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.626 -0.797 . . . . 5.57 112.291 179.665 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 70' ' ' GLN . . . . . 0.624 ' HB2' ' HB3' ' B' ' 67' ' ' LEU . 26.6 mm-40 -128.45 163.66 24.42 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.665 -0.495 . . . . 5.43 109.665 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 71' ' ' VAL . . . . . 0.443 ' HB ' ' HD1' ' B' ' 93' ' ' PHE . 9.8 p -116.72 131.16 70.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 121.27 0.557 . . . . 5.65 111.068 -179.232 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 21.0 tp -118.46 116.02 25.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.932 -0.577 . . . . 4.51 109.616 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 73' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.8 m -92.31 114.77 27.41 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.836 -0.62 . . . . 6.35 111.351 -179.072 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 74' ' ' VAL . . . . . 0.437 HG13 ' HB ' ' B' ' 90' ' ' THR . 2.5 p -108.04 128.8 63.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.931 -0.577 . . . . 4.34 110.0 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 27.9 ttt -102.16 108.08 19.37 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.032 0.444 . . . . 5.42 110.525 -179.537 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.426 ' HE2' ' HD1' ' B' ' 78' ' ' PHE . 26.8 p90 -138.49 -171.45 3.06 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.895 -0.593 . . . . 3.54 109.893 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 77' ' ' ARG . . . . . 0.615 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 59.0 mtm180 -114.66 119.29 36.23 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.15 0.5 . . . . 6.8 110.53 179.27 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.523 ' HD2' HG11 ' B' ' 33' ' ' VAL . 19.7 t80 -99.53 144.85 28.15 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.451 -0.795 . . . . 5.79 110.504 -179.055 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 79' ' ' ARG . . . . . . . . . . . . . 39.7 ttp180 -82.62 120.02 25.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.365 -0.38 . . . . 11.08 110.208 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 80' ' ' SER . . . . . 0.486 ' OG ' ' HG2' ' B' ' 84' ' ' GLU . 99.8 p -87.71 -175.21 5.09 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.841 0.353 . . . . 7.47 110.747 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 39.8 tptt -66.37 -16.72 64.29 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.023 -0.535 . . . . 12.24 110.418 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 23.7 m-20 -92.84 4.18 54.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.02 -0.536 . . . . 9.25 109.837 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 68.86 16.36 8.85 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.323 -0.853 . . . . 8.3 112.029 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 84' ' ' GLU . . . . . 0.486 ' HG2' ' OG ' ' B' ' 80' ' ' SER . 13.4 pt-20 -97.01 148.08 23.35 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.683 -0.488 . . . . 6.78 109.683 179.427 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 85' ' ' TRP . . . . . 0.615 ' HB3' ' HB3' ' B' ' 77' ' ' ARG . 2.7 m95 -95.05 103.63 15.49 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.089 -0.337 . . . . 7.89 110.089 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.509 HD21 HG12 ' B' ' 33' ' ' VAL . 1.6 pp -97.45 146.43 25.22 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.515 -0.311 . . . . 6.97 110.645 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 87' ' ' TRP . . . . . 0.59 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 87.0 m95 -72.8 116.97 13.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.392 -0.367 . . . . 8.55 110.111 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 88' ' ' MET . . . . . 0.416 ' SD ' ' HB3' ' B' ' 110' ' ' ASN . 3.9 ttp -131.3 134.57 46.49 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.01 -0.541 . . . . 4.46 110.657 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 37.5 ttp180 -96.98 105.28 17.4 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.72 -0.673 . . . . 6.87 109.353 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 90' ' ' THR . . . . . 0.776 HG23 ' HB3' ' B' ' 108' ' ' CYS . 19.7 m -88.32 106.89 18.53 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.895 -0.593 . . . . 6.18 111.014 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 91' ' ' SER . . . . . 0.454 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 0.8 OUTLIER -87.9 88.58 7.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.827 -0.624 . . . . 6.3 109.321 179.129 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 9.3 m -80.49 122.65 27.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.082 -0.508 . . . . 6.65 111.968 -178.251 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 93' ' ' PHE . . . . . 0.443 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 77.6 t80 -115.47 125.46 53.11 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.261 -0.427 . . . . 6.45 109.949 178.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 94' ' ' THR . . . . . 0.625 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.4 OUTLIER -88.33 104.3 16.63 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.757 0.313 . . . . 9.17 110.735 179.763 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -71.7 132.45 44.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.307 -0.406 . . . . 8.33 110.541 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 96' ' ' GLN . . . . . 0.433 ' OE1' ' HA3' ' B' ' 69' ' ' GLY . 50.9 mt-30 -99.0 137.65 37.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.851 -0.613 . . . . 10.53 111.851 -178.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 97' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -89.85 124.13 64.51 Favored Pre-proline 0 C--N 1.323 -0.568 0 N-CA-C 108.329 -0.989 . . . . 8.43 108.329 177.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.54 51.19 1.11 Allowed 'Trans proline' 0 CA--C 1.534 0.479 0 C-N-CA 123.137 2.558 . . . . 9.16 113.703 -179.284 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -138.02 -77.82 0.37 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.547 -0.297 . . . . 11.34 110.425 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 14.7 m -113.24 20.11 16.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.128 0.49 . . . . 7.75 109.908 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.6 t0 61.66 35.03 17.27 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.087 -0.961 . . . . 9.08 111.341 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -82.07 164.93 21.04 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.967 -0.561 . . . . 7.71 109.767 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 69.4 mt -103.33 118.77 50.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.486 -0.324 . . . . 8.04 110.284 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -66.09 -64.26 0.9 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.063 0.458 . . . . 8.81 109.788 179.564 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 6.6 p90 -157.92 172.47 18.4 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.392 -0.822 . . . . 7.4 109.666 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 57.8 mt -102.96 113.16 38.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.403 -0.362 . . . . 6.78 110.081 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 13.2 mt -88.91 105.52 15.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 109.332 -0.618 . . . . 6.31 109.332 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 108' ' ' CYS . . . . . 0.776 ' HB3' HG23 ' B' ' 90' ' ' THR . 97.1 m -99.25 106.1 18.19 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.375 0.509 . . . . 5.31 112.375 -178.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 109' ' ' THR . . . . . 0.454 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 2.9 m -79.89 84.26 5.69 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.647 -0.872 . . . . 5.48 108.647 177.51 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 110' ' ' ASN . . . . . 0.416 ' HB3' ' SD ' ' B' ' 88' ' ' MET . 7.3 m-20 -71.16 121.71 18.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.552 -0.749 . . . . 6.9 111.752 -178.286 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.13 116.63 22.36 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.213 -0.448 . . . . 8.61 110.111 179.045 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 112' ' ' ASN . . . . . 0.475 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 8.1 t-20 -68.44 135.3 51.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.116 0.484 . . . . 11.84 110.875 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 2.0 t -109.12 -50.12 7.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.683 -0.69 . . . . 11.77 109.9 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 114' ' ' LYS . . . . . 0.59 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 92.0 mttt . . . . . 0 C--O 1.246 0.905 0 CA-C-O 118.61 -0.71 . . . . 12.68 109.829 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.428 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 74.1 mm-40 . . . . . 0 N--CA 1.455 -0.176 0 N-CA-C 109.794 -0.447 . . . . 15.08 109.794 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 8' ' ' GLN . 13.1 Cg_exo -69.57 159.9 51.79 Favored 'Trans proline' 0 C--O 1.233 0.271 0 C-N-CA 122.805 2.337 . . . . 13.43 112.664 -179.612 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.506 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.0 OUTLIER -86.87 55.77 3.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.853 -0.612 . . . . 11.09 110.233 179.79 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.479 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 8.8 tt0 -157.55 144.06 17.9 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.492 -0.776 . . . . 10.59 109.728 -178.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.818 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 27.2 p90 -150.63 143.58 24.69 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.066 0.46 . . . . 8.93 111.114 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.471 HG23 HG23 ' A' ' 107' ' ' ILE . 50.5 mm -80.0 115.23 22.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.902 -0.59 . . . . 8.66 110.444 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.917 ' HB3' ' HE2' ' A' ' 22' ' ' PHE . 1.6 m -100.21 99.52 10.22 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.986 -0.552 . . . . 6.11 110.94 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.646 ' HD3' ' HB3' ' A' ' 24' ' ' PHE . 15.1 mtp180 -91.72 106.7 18.67 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.419 -0.586 . . . . 9.09 109.419 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.8 p80 -133.73 159.98 38.94 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.507 -0.315 . . . . 9.79 110.887 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -75.82 179.32 5.55 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.336 -0.393 . . . . 12.69 110.618 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.1 pt -53.93 -36.45 30.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 112.528 0.566 . . . . 13.58 112.528 -179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -68.82 -46.47 68.54 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.989 0.424 . . . . 13.85 111.039 -179.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 137.22 -8.46 3.79 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.609 -0.805 . . . . 9.38 111.724 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.463 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 33.5 mm -64.99 116.1 3.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 109.908 -0.405 . . . . 10.74 109.908 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.917 ' HE2' ' HB3' ' A' ' 14' ' ' SER . 89.7 m-85 -66.82 122.33 17.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.156 -0.474 . . . . 9.73 110.885 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.82 -32.59 13.89 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.678 -0.692 . . . . 7.74 109.735 179.379 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.646 ' HB3' ' HD3' ' A' ' 15' ' ' ARG . 55.1 t80 -147.43 133.63 19.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.517 -0.765 . . . . 6.92 109.337 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.506 HG21 ' HB2' ' A' ' 40' ' ' LEU . 22.1 t -119.41 147.19 23.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.253 0.549 . . . . 6.02 111.606 -178.851 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.818 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 5.4 t70 -68.8 -179.55 1.47 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 114.911 -1.04 . . . . 7.31 110.499 179.27 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 25.8 m170 -108.34 -20.29 13.18 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.105 0.479 . . . . 11.67 110.226 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 63.9 mtm180 -76.94 -6.68 53.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.83 -0.623 . . . . 11.91 111.272 -179.514 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 25.1 p -57.65 -31.23 66.09 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.344 -0.389 . . . . 12.99 111.376 -179.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.491 ' O ' ' HA2' ' A' ' 34' ' ' GLY . 13.4 t -62.84 -31.43 52.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.943 -0.571 . . . . 16.15 111.057 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -92.77 -17.54 24.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.966 0.412 . . . . 15.07 110.781 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.443 ' HA ' HG22 ' A' ' 10' ' ' THR . 5.3 m -82.11 -67.33 0.79 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.067 -0.515 . . . . 14.9 110.927 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 2.4 m -113.11 -8.79 12.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.381 -0.372 . . . . 13.84 111.51 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.491 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 85.56 -2.64 87.9 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.519 -0.848 . . . . 13.85 112.234 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -78.16 136.7 37.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.858 0.361 . . . . 18.28 110.771 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.556 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 9.6 mm100 -77.98 149.31 76.65 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 108.708 -0.849 . . . . 15.48 108.708 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.432 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 76.4 Cg_exo -51.3 -38.19 61.63 Favored 'Trans proline' 0 CA--C 1.53 0.287 0 C-N-CA 122.555 2.17 . . . . 11.63 112.853 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.531 ' HA ' HD12 ' A' ' 41' ' ' LEU . 19.9 mp0 -71.67 -14.84 62.16 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.155 -0.475 . . . . 13.31 111.729 -179.075 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.556 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 31.5 mt-10 -81.18 -22.8 38.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.788 0.328 . . . . 17.34 110.295 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.506 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.9 mm? -94.68 -34.68 12.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.978 -0.555 . . . . 13.25 109.989 179.519 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.531 HD12 ' HA ' ' A' ' 38' ' ' GLN . 82.5 mt -57.88 120.89 9.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.808 -0.633 . . . . 12.99 111.068 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.15 3.3 87.52 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.66 -0.781 . . . . 13.39 112.471 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.758 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 8.7 mmpt? -112.64 163.25 14.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.86 0.362 . . . . 16.87 110.3 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.682 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 7.8 m120 -96.41 137.53 35.34 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.997 -0.547 . . . . 12.5 110.008 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 19.7 tt -63.47 -23.37 33.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.113 0.482 . . . . 11.72 111.075 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.44 HG12 ' HB3' ' A' ' 44' ' ' ASN . 8.3 p -78.73 -16.49 13.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.275 -0.42 . . . . 12.89 111.445 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.682 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.2 mt-10 -69.36 -39.83 77.86 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.019 0.437 . . . . 16.53 110.817 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.416 ' HB2' ' CZ ' ' A' ' 78' ' ' PHE . 22.8 m-85 -97.91 23.89 7.54 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.015 -0.539 . . . . 15.34 110.402 -179.43 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 52.4 t -104.94 147.18 28.06 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 115.847 -0.615 . . . . 11.97 110.066 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.461 ' CD2' ' HD2' ' A' ' 51' ' ' PRO . 8.4 t-160 -58.98 127.38 83.48 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.128 -0.487 . . . . 14.67 109.734 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.461 ' HD2' ' CD2' ' A' ' 50' ' ' HIS . 88.9 Cg_exo -43.6 -50.73 6.74 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.308 2.672 . . . . 15.15 113.77 -179.271 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.49 -3.27 17.02 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.48 0.548 . . . . 16.47 112.48 -179.635 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -120.58 1.83 10.64 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 122.195 -0.315 . . . . 13.16 110.901 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -62.85 -47.45 83.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.175 -0.466 . . . . 15.83 111.406 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 44.8 tp60 -69.38 -34.71 74.94 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.57 -0.53 . . . . 13.94 109.57 178.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.7 tp -57.76 -40.87 80.78 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.34 0.59 . . . . 12.11 109.81 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.407 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.7 OUTLIER -66.81 -46.06 76.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.468 -0.787 . . . . 9.71 110.02 179.052 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 69.1 ttt180 -61.45 -43.67 98.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.143 -0.481 . . . . 11.06 110.775 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -58.91 -39.13 80.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.214 0.53 . . . . 9.71 110.288 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.3 m -72.36 -33.9 67.61 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.679 -0.691 . . . . 9.52 110.618 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.523 ' O ' HG12 ' A' ' 64' ' ' VAL . 4.6 m-85 -64.29 -45.99 85.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.887 0.375 . . . . 11.4 110.207 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 73.1 mm-40 -64.15 -33.06 74.92 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.991 0.424 . . . . 10.04 109.928 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -64.77 -48.87 72.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.777 -0.647 . . . . 10.6 110.724 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.603 ' HA ' HD12 ' A' ' 67' ' ' LEU . 4.2 p -65.17 -26.93 40.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 CA-C-N 116.646 -0.252 . . . . 10.62 111.268 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 61' ' ' PHE . 55.5 t -69.31 -37.28 75.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 121.299 0.571 . . . . 12.41 109.694 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 27.4 mtpt -78.99 -33.0 45.42 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.794 -0.639 . . . . 16.25 109.946 179.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.727 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 66.6 mt -60.0 -56.56 20.14 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.914 -0.584 . . . . 12.66 110.639 179.531 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 65.3 mttt 62.21 103.65 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 O-C-N 123.861 0.726 . . . . 14.83 112.163 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 83.69 19.81 61.03 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.369 -0.919 . . . . 9.8 112.132 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.727 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 59.1 tp60 -128.84 139.35 52.21 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.167 -0.679 . . . . 9.59 109.167 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.487 ' CG2' ' HB3' ' A' ' 91' ' ' SER . 2.6 p -97.25 117.4 41.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.129 0.49 . . . . 8.1 110.383 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 46.4 tp -106.33 117.08 33.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.907 -0.588 . . . . 7.8 110.488 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.531 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 9.1 m -93.79 106.93 18.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.054 -0.521 . . . . 7.59 110.97 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.2 p -99.67 132.02 45.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.186 -0.461 . . . . 7.84 110.19 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 23.6 ttt -102.86 119.45 38.86 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.344 -0.389 . . . . 9.35 110.344 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.501 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 46.8 p90 -150.32 -174.67 4.81 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.787 -0.642 . . . . 9.66 109.385 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.464 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 36.1 mtm180 -107.38 121.79 45.29 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.153 0.501 . . . . 13.1 110.954 179.412 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.501 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 13.0 t80 -104.12 148.46 26.24 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.352 -0.84 . . . . 9.28 109.728 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.616 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 1.1 ttt180 -88.09 123.67 33.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.9 0.381 . . . . 10.87 110.735 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.557 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 85.2 p -85.38 -176.5 6.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.018 -0.537 . . . . 10.77 109.908 179.035 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.436 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 35.4 tptt -67.97 -17.3 64.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.321 0.581 . . . . 12.66 109.755 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -88.34 2.92 51.51 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.581 -0.736 . . . . 14.42 110.247 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 67.23 19.32 10.3 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 115.596 -0.729 . . . . 12.69 110.842 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.557 ' HG2' ' OG ' ' A' ' 80' ' ' SER . 5.8 pt-20 -94.59 154.37 17.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.087 -0.506 . . . . 10.85 109.902 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.616 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 44.7 m95 -101.36 105.77 16.86 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.422 -0.354 . . . . 11.2 110.61 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.464 ' O ' ' HA ' ' A' ' 77' ' ' ARG . 1.5 pp -107.92 151.63 25.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.23 -0.441 . . . . 11.12 110.385 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.571 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 89.8 m95 -78.43 120.88 23.79 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.073 0.463 . . . . 10.28 110.7 -179.247 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 5.9 tpp -122.96 140.2 53.27 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.748 -0.66 . . . . 9.32 111.071 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -102.44 94.37 5.65 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.343 -0.984 . . . . 10.66 108.343 177.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.584 HG23 ' HB3' ' A' ' 108' ' ' CYS . 45.4 m -86.92 105.21 16.93 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.893 -0.594 . . . . 9.37 112.048 -178.591 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.811 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 70.8 m -88.29 92.34 9.13 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.981 -0.554 . . . . 8.27 109.629 178.341 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' A' ' 108' ' ' CYS . 14.5 m -81.08 124.03 28.87 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.809 -0.632 . . . . 8.65 111.03 -178.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -121.57 120.16 34.02 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.815 -0.63 . . . . 11.56 109.488 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.09 115.11 10.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.875 0.369 . . . . 10.16 111.199 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -92.34 109.47 20.85 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.236 -0.438 . . . . 12.25 109.97 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.405 ' HA ' ' HA ' ' A' ' 103' ' ' ILE . 38.3 mt-30 -104.68 152.09 22.92 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.818 -0.628 . . . . 14.24 111.316 -179.26 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -91.75 137.95 25.26 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.67 -0.695 . . . . 13.83 109.425 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -73.6 36.59 0.39 Allowed 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 122.695 2.263 . . . . 15.34 113.451 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -109.77 -68.61 0.91 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.786 0.327 . . . . 16.89 110.545 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.64 20.68 8.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.335 -0.393 . . . . 14.89 110.806 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 24.2 t70 67.8 23.61 8.46 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.55 0.691 . . . . 14.77 110.406 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -82.87 142.98 31.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.055 -0.52 . . . . 12.95 111.217 -178.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.405 ' HA ' ' HA ' ' A' ' 96' ' ' GLN . 43.9 mt -87.27 113.5 24.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.191 -0.458 . . . . 11.11 110.274 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.409 ' H ' ' HG2' ' A' ' 104' ' ' GLU . 4.6 pt-20 -77.46 -41.76 38.45 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 121.069 -0.252 . . . . 11.65 110.415 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 29.4 p90 -163.82 175.15 10.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.697 0.285 . . . . 10.3 110.353 178.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 60.2 mt -118.4 121.88 68.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 116.283 -0.417 . . . . 10.29 110.449 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.493 HG12 ' HG2' ' A' ' 15' ' ' ARG . 42.1 mt -90.26 107.65 18.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.704 -0.48 . . . . 8.99 109.704 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.584 ' HB3' HG23 ' A' ' 90' ' ' THR . 72.8 m -98.96 112.7 24.74 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.186 0.517 . . . . 9.83 111.017 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.811 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 7.7 m -83.02 90.87 7.07 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.769 -0.826 . . . . 10.84 108.769 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.479 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 6.3 m-20 -79.29 94.63 5.5 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.825 -0.625 . . . . 11.26 111.67 -178.466 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 6.5 m -104.05 113.77 27.54 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.835 -0.431 . . . . 11.22 109.835 178.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ASN . . . . . 0.506 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 5.3 t30 -68.46 135.19 51.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.151 0.501 . . . . 12.78 111.097 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.416 HG12 ' HG3' ' A' ' 114' ' ' LYS . 40.7 t -109.3 -51.62 6.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.667 -0.697 . . . . 14.64 109.999 179.568 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.571 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 44.4 mtpt . . . . . 0 C--O 1.253 1.262 0 CA-C-O 118.276 -0.868 . . . . 16.02 109.917 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 22.0 m . . . . . 0 N--CA 1.478 0.946 0 CA-C-O 120.857 0.361 . . . . 7.49 110.074 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -138.65 163.54 46.13 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.349 -0.387 . . . . 7.12 110.77 -178.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.48 167.59 23.62 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.895 2.396 . . . . 6.18 112.023 179.256 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 10' ' ' THR . . . . . 0.611 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.0 OUTLIER -83.17 58.49 4.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.235 0.54 . . . . 5.81 111.145 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.669 ' HA ' ' O ' ' B' ' 110' ' ' ASN . 22.6 tt0 -162.09 129.05 3.79 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.496 -0.775 . . . . 5.85 109.443 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -138.55 154.69 48.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.199 0.523 . . . . 6.08 111.661 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.649 ' HB ' ' HB2' ' B' ' 26' ' ' ASP . 10.5 mm -88.35 120.43 37.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.54 -0.755 . . . . 5.57 110.664 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.71 ' HB3' ' HE2' ' B' ' 22' ' ' PHE . 0.7 OUTLIER -108.58 93.71 4.67 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.776 -0.647 . . . . 5.3 110.374 179.723 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 15' ' ' ARG . . . . . 0.625 ' HD3' ' HB3' ' B' ' 24' ' ' PHE . 11.2 mtp85 -85.72 108.65 18.15 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.375 -0.602 . . . . 8.97 109.375 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 16' ' ' HIS . . . . . 0.483 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 30.3 p80 -141.44 166.03 25.88 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.44 -0.345 . . . . 8.31 111.14 -179.152 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 12.0 p-10 -79.36 -177.76 5.9 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.235 -0.439 . . . . 10.83 110.469 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 18' ' ' ILE . . . . . 0.458 HG13 ' N ' ' B' ' 19' ' ' GLU . 9.8 pt -59.1 -35.02 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 112.459 0.54 . . . . 8.89 112.459 -178.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 19' ' ' GLU . . . . . 0.458 ' N ' HG13 ' B' ' 18' ' ' ILE . 18.2 mt-10 -71.87 -28.3 63.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.018 0.437 . . . . 11.92 111.29 -179.371 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 117.44 -1.91 18.43 Favored Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 120.428 -0.892 . . . . 8.57 113.168 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 21' ' ' ILE . . . . . 0.458 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 36.9 mm -66.29 111.17 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.03 -0.359 . . . . 10.87 110.03 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 22' ' ' PHE . . . . . 0.71 ' HE2' ' HB3' ' B' ' 14' ' ' SER . 95.5 m-85 -66.85 130.92 44.72 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.175 -0.466 . . . . 8.23 110.941 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 1.1 m -108.6 -27.55 9.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.923 -0.581 . . . . 7.91 110.64 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 24' ' ' PHE . . . . . 0.625 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 15.7 t80 -160.21 137.19 9.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.014 -0.539 . . . . 7.89 109.97 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 10.9 t -125.69 146.06 32.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.429 -0.35 . . . . 6.1 110.811 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 26' ' ' ASP . . . . . 0.649 ' HB2' ' HB ' ' B' ' 13' ' ' ILE . 5.8 t0 -71.16 161.89 30.35 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.463 -0.569 . . . . 7.15 109.463 179.036 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -80.26 37.03 0.37 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.811 0.339 . . . . 8.97 111.251 -179.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 28' ' ' ARG . . . . . 0.508 ' HD2' ' O ' ' B' ' 11' ' ' GLU . 29.0 mtm180 -128.39 3.07 5.66 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.887 0.375 . . . . 9.76 111.114 -179.292 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 1.8 p -62.74 -46.77 86.51 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 112.413 0.523 . . . . 11.56 112.413 -178.396 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 6.7 t -67.54 -26.48 35.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 121.079 0.466 . . . . 13.64 111.038 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.87 -22.13 43.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.217 -0.447 . . . . 12.9 111.108 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 13.0 m -92.57 -59.7 2.01 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.29 0.478 . . . . 12.13 112.29 -178.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 33' ' ' VAL . . . . . 0.561 HG12 HD21 ' B' ' 86' ' ' LEU . 3.2 m -118.63 -5.53 11.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 112.195 0.442 . . . . 13.87 112.195 -178.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.3 20.34 64.76 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.536 -0.84 . . . . 13.79 112.21 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 35' ' ' TYR . . . . . 0.455 ' HD1' ' HA ' ' B' ' 35' ' ' TYR . 1.0 OUTLIER -93.0 130.72 38.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.675 0.274 . . . . 15.38 110.909 -179.726 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -75.0 144.86 80.13 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 109.111 -0.7 . . . . 13.78 109.111 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.442 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 52.2 Cg_exo -54.52 -32.99 76.42 Favored 'Trans proline' 0 CA--C 1.529 0.233 0 C-N-CA 122.459 2.106 . . . . 14.71 112.23 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 38' ' ' GLN . . . . . 0.566 ' HA ' HD12 ' B' ' 41' ' ' LEU . 26.9 mp0 -75.52 -17.11 60.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.615 -0.721 . . . . 17.54 111.971 -179.407 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -75.54 -40.26 57.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.96 0.409 . . . . 14.24 110.574 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.524 ' HB3' ' CG ' ' B' ' 22' ' ' PHE . 1.9 mm? -74.84 -26.02 59.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.836 -0.62 . . . . 14.03 111.201 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.566 HD12 ' HA ' ' B' ' 38' ' ' GLN . 75.3 mt -61.48 119.8 9.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 13.62 111.469 -179.095 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.6 11.72 79.32 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.834 -0.698 . . . . 11.62 113.055 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.591 ' HE2' ' HA ' ' B' ' 43' ' ' LYS . 8.6 mmpt? -121.88 158.58 28.67 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.754 0.311 . . . . 13.82 110.479 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 44' ' ' ASN . . . . . 0.56 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 12.4 m120 -94.16 139.94 30.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.055 -0.52 . . . . 10.16 109.84 179.44 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.6 tt -62.08 -24.48 34.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.996 0.427 . . . . 9.62 111.378 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 6.3 p -71.88 -18.29 19.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.172 -0.467 . . . . 11.5 111.217 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 47' ' ' GLU . . . . . 0.56 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 38.1 mt-10 -75.81 -23.15 55.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.995 0.426 . . . . 11.89 111.031 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -110.09 22.05 16.05 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.023 -0.535 . . . . 13.6 110.092 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 51.4 t -110.6 150.87 28.34 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.682 -0.69 . . . . 10.81 110.451 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -59.64 126.24 82.19 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.807 -0.633 . . . . 11.49 109.576 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 51' ' ' PRO . . . . . 0.407 ' HA ' ' OE1' ' B' ' 54' ' ' GLN . 81.9 Cg_exo -47.29 -42.21 27.55 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.058 2.505 . . . . 11.35 113.58 -179.332 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 9.1 mp0 -78.45 0.32 26.31 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 112.334 0.494 . . . . 9.28 112.334 -179.525 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -129.83 5.05 5.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.888 0.375 . . . . 7.52 110.933 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 54' ' ' GLN . . . . . 0.407 ' OE1' ' HA ' ' B' ' 51' ' ' PRO . 70.8 mt-30 -63.75 -43.46 96.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.104 -0.498 . . . . 6.57 110.719 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 49.6 tp60 -63.63 -39.63 94.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.956 -0.566 . . . . 6.58 109.535 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.78 -42.42 84.08 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.986 -0.552 . . . . 4.6 110.498 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.439 HD23 ' HA ' ' B' ' 57' ' ' LEU . 0.5 OUTLIER -63.72 -51.76 63.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 6.4 110.269 179.489 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 58' ' ' ARG . . . . . 0.404 ' O ' ' HG2' ' B' ' 62' ' ' GLN . 70.8 ttt180 -58.79 -44.29 90.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.82 -0.627 . . . . 8.18 110.878 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -59.25 -42.87 92.13 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.749 -0.66 . . . . 6.07 110.975 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 20.3 m -66.82 -34.02 76.9 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.867 -0.606 . . . . 5.59 110.592 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 61' ' ' PHE . . . . . 0.408 ' O ' HG12 ' B' ' 64' ' ' VAL . 9.5 m-85 -64.64 -37.87 89.05 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.104 0.478 . . . . 7.73 109.781 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 62' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' B' ' 58' ' ' ARG . 93.8 mm-40 -63.99 -44.45 92.62 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.805 -0.634 . . . . 6.89 110.524 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -68.08 -40.44 82.68 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.615 -0.721 . . . . 9.4 111.776 -179.234 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.412 HG21 ' O ' ' B' ' 92' ' ' SER . 9.5 p -68.17 -28.57 41.39 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 C-N-CA 120.861 -0.336 . . . . 7.57 110.512 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 65' ' ' VAL . . . . . 0.411 ' HA ' HG21 ' B' ' 94' ' ' THR . 20.3 t -71.46 -37.25 63.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.01 -0.737 . . . . 7.43 109.01 178.113 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 18.3 mtpt -68.82 -37.52 79.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.527 -0.761 . . . . 10.21 110.278 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 48.2 mt -62.02 -49.45 75.99 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.909 -0.587 . . . . 7.2 110.292 179.333 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 22.1 mttt 63.85 112.23 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 O-C-N 124.006 0.816 . . . . 7.58 112.46 179.133 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 77.18 23.07 69.46 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.851 -0.69 . . . . 5.57 112.72 178.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -129.8 166.16 20.48 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.818 0.342 . . . . 5.43 110.697 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 71' ' ' VAL . . . . . 0.642 ' HB ' ' HD1' ' B' ' 93' ' ' PHE . 2.8 p -116.19 120.34 64.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.874 -0.603 . . . . 5.65 110.874 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 46.3 tp -107.22 119.5 39.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.914 -0.584 . . . . 4.51 109.96 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 73' ' ' SER . . . . . 0.413 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 0.9 OUTLIER -89.38 111.73 22.66 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.97 -0.559 . . . . 6.35 110.781 -179.48 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.4 p -110.84 132.39 59.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.859 -0.423 . . . . 4.34 109.859 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 21.7 ttt -106.45 114.96 29.39 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.095 0.474 . . . . 5.42 110.972 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.546 ' HE2' ' HD1' ' B' ' 78' ' ' PHE . 49.6 p90 -144.96 -175.35 4.65 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.505 -0.771 . . . . 3.54 108.998 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 77' ' ' ARG . . . . . 0.464 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 40.4 mtm180 -106.7 118.47 36.75 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.048 0.451 . . . . 6.8 110.497 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.546 ' HD1' ' HE2' ' B' ' 76' ' ' PHE . 14.8 t80 -97.13 145.66 25.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.297 -0.865 . . . . 5.79 110.201 -179.374 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 79' ' ' ARG . . . . . 0.532 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 22.4 ttp180 -85.8 129.72 34.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.3 -0.409 . . . . 11.08 110.676 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 80' ' ' SER . . . . . 0.547 ' HA ' ' HB ' ' B' ' 33' ' ' VAL . 88.6 p -89.77 -177.83 5.35 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.704 -0.48 . . . . 7.47 109.704 178.628 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 51.6 tptt -68.47 -23.38 64.58 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.325 0.583 . . . . 12.24 109.547 178.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -86.13 4.66 37.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.631 -0.713 . . . . 9.25 110.349 178.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 67.07 29.23 8.04 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.45 -0.796 . . . . 8.3 111.469 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 84' ' ' GLU . . . . . 0.457 ' O ' ' HA ' ' B' ' 79' ' ' ARG . 1.7 pt-20 -95.88 152.91 18.07 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.153 -0.684 . . . . 6.78 109.153 178.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 85' ' ' TRP . . . . . 0.532 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 73.2 m95 -104.31 93.89 5.06 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.792 0.33 . . . . 7.89 110.384 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.561 HD21 HG12 ' B' ' 33' ' ' VAL . 1.8 pp -96.99 148.8 22.6 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.224 -0.444 . . . . 6.97 110.494 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 87' ' ' TRP . . . . . 0.497 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 90.5 m95 -72.82 121.99 20.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.965 0.412 . . . . 8.55 110.581 -179.635 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 27.2 tpp -122.47 131.62 53.95 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.782 -0.645 . . . . 4.46 110.981 -178.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 15.9 ttp180 -100.38 72.69 1.62 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.517 -0.92 . . . . 6.87 108.517 178.365 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 90' ' ' THR . . . . . 0.51 HG23 ' HB3' ' B' ' 108' ' ' CYS . 54.0 m -66.81 113.02 4.56 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.201 -0.908 . . . . 6.18 112.083 -178.851 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 91' ' ' SER . . . . . 0.413 ' HA ' ' HA ' ' B' ' 73' ' ' SER . 1.6 m -95.1 96.82 9.49 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.935 -0.765 . . . . 6.3 108.935 178.783 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 92' ' ' SER . . . . . 0.467 ' O ' ' HA ' ' B' ' 71' ' ' VAL . 16.3 m -84.06 117.39 23.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.274 -0.421 . . . . 6.65 111.819 -178.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 93' ' ' PHE . . . . . 0.642 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 71.2 t80 -110.08 122.12 46.84 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.086 -0.506 . . . . 6.45 110.161 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 94' ' ' THR . . . . . 0.411 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.7 OUTLIER -87.3 118.4 26.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.755 0.312 . . . . 9.17 111.01 179.796 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 95' ' ' PHE . . . . . 0.459 ' O ' ' HA ' ' B' ' 103' ' ' ILE . 0.0 OUTLIER -83.58 130.9 35.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.811 0.339 . . . . 8.33 110.919 -179.837 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -104.71 111.04 23.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.964 -0.562 . . . . 10.53 110.958 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 97' ' ' ASN . . . . . 0.478 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 65.3 t30 -74.32 127.3 87.93 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 109.513 -0.551 . . . . 8.43 109.513 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 98' ' ' PRO . . . . . 0.478 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 62.1 Cg_endo -74.71 20.02 0.45 Allowed 'Trans proline' 0 CA--C 1.535 0.554 0 C-N-CA 122.714 2.276 . . . . 9.16 113.884 -179.515 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -91.69 -56.72 3.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.938 0.399 . . . . 11.34 110.1 179.66 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 100' ' ' SER . . . . . 0.427 ' HB2' ' HG3' ' B' ' 102' ' ' GLU . 1.4 m -135.95 16.46 3.28 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.531 -0.544 . . . . 7.75 109.531 179.055 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 23.7 t70 63.84 40.26 7.68 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.232 -0.894 . . . . 9.08 110.497 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 102' ' ' GLU . . . . . 0.427 ' HG3' ' HB2' ' B' ' 100' ' ' SER . 0.0 OUTLIER -96.83 158.87 15.22 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.708 -0.678 . . . . 7.71 110.481 179.948 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 103' ' ' ILE . . . . . 0.459 ' HA ' ' O ' ' B' ' 95' ' ' PHE . 68.7 mt -95.44 105.05 16.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.709 -0.478 . . . . 8.04 109.709 179.082 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -60.59 -52.33 65.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.84 -0.618 . . . . 8.81 110.962 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -164.37 171.16 15.13 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.613 -0.721 . . . . 7.4 110.019 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 37.8 mt -108.47 119.54 58.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.952 -0.567 . . . . 6.78 109.951 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.408 ' HB ' ' HB3' ' B' ' 93' ' ' PHE . 33.5 mt -86.6 97.98 6.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 109.443 -0.577 . . . . 6.31 109.443 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 108' ' ' CYS . . . . . 0.51 ' HB3' HG23 ' B' ' 90' ' ' THR . 92.5 m -92.68 104.38 16.66 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.178 0.436 . . . . 5.31 112.178 -179.103 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 109' ' ' THR . . . . . 0.414 ' HA ' HD13 ' B' ' 13' ' ' ILE . 3.5 m -78.28 97.46 5.57 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.606 -0.887 . . . . 5.48 108.606 177.783 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 110' ' ' ASN . . . . . 0.669 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.2 m-20 -80.56 89.02 5.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.012 -0.54 . . . . 6.9 111.78 -178.118 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 3.3 m -94.78 112.55 24.28 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.199 -0.455 . . . . 8.61 110.496 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 112' ' ' ASN . . . . . 0.611 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 4.2 t-20 -70.49 131.66 44.37 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.068 0.461 . . . . 11.84 110.779 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 93.5 t -104.79 -55.94 5.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.591 -0.732 . . . . 11.77 109.986 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 114' ' ' LYS . . . . . 0.497 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 42.2 mtpt . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.197 -0.906 . . . . 12.68 109.937 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 . . . . . 0 C--O 1.232 0.15 0 N-CA-C 110.239 -0.282 . . . . 15.08 110.239 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.408 ' HG2' ' HD2' ' A' ' 28' ' ' ARG . 33.0 Cg_endo -65.75 154.32 74.38 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.572 2.181 . . . . 13.43 111.94 179.496 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.715 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.8 OUTLIER -77.35 43.25 0.37 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.229 0.538 . . . . 11.09 111.33 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.571 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 32.8 tt0 -145.75 126.48 14.33 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.852 -0.796 . . . . 10.59 108.852 -179.306 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.957 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 33.5 p90 -145.35 156.42 43.78 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.088 0.47 . . . . 8.93 111.342 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.567 HG23 HG23 ' A' ' 107' ' ' ILE . 21.8 mm -85.31 117.13 29.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.681 -0.69 . . . . 8.66 110.995 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.434 ' HB3' ' HE1' ' A' ' 22' ' ' PHE . 0.8 OUTLIER -105.75 92.5 4.2 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.119 -0.492 . . . . 6.11 110.294 179.481 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 15' ' ' ARG . 6.4 mtt180 -81.48 117.59 22.03 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.482 -0.562 . . . . 9.09 109.482 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.1 p80 -149.16 159.28 44.38 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.921 -0.311 . . . . 9.79 111.041 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.2 p-10 -80.76 178.06 8.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.308 -0.406 . . . . 12.69 110.349 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.9 pt -58.56 -28.07 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 113.087 0.773 . . . . 13.58 113.087 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -75.06 -23.65 58.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.28 0.562 . . . . 13.85 110.878 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 112.84 -7.27 25.74 Favored Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 120.841 -0.695 . . . . 9.38 111.748 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.461 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 38.9 mm -66.88 115.19 4.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 110.011 -0.366 . . . . 10.74 110.011 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.461 ' CZ ' ' HB ' ' A' ' 45' ' ' ILE . 98.0 m-85 -71.37 128.59 36.38 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.953 -0.567 . . . . 9.73 111.402 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 23.4 p -95.04 -31.59 13.52 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.25 -0.886 . . . . 7.74 110.102 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -155.47 132.16 10.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.465 -0.789 . . . . 6.92 109.423 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.656 HG21 ' HB2' ' A' ' 40' ' ' LEU . 21.6 t -116.99 143.38 27.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.722 0.296 . . . . 6.02 110.972 -179.22 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.957 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 6.9 t70 -67.23 166.03 14.98 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.76 -0.654 . . . . 7.31 110.396 179.239 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 51.5 m170 -87.82 -13.28 42.58 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.928 0.395 . . . . 11.67 110.648 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.488 HH22 HG21 ' B' ' 107' ' ' ILE . 79.2 mtm180 -81.73 -1.96 48.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.227 -0.442 . . . . 11.91 112.033 -179.239 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 29.2 p -65.04 -30.45 71.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.945 0.402 . . . . 12.99 111.257 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 24.7 t -61.47 -39.72 83.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.838 -0.619 . . . . 16.15 111.665 -179.102 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.73 -18.19 33.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.703 0.287 . . . . 15.07 111.426 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.3 m -85.09 -53.3 5.36 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.344 -0.389 . . . . 14.9 111.917 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.48 HG23 ' H ' ' A' ' 35' ' ' TYR . 3.7 m -123.5 -15.5 5.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.2 0.445 . . . . 13.84 112.2 -179.143 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 92.41 -13.82 66.28 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.439 -0.886 . . . . 13.85 111.833 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.48 ' H ' HG23 ' A' ' 33' ' ' VAL . 4.7 m-30 -71.46 133.04 45.6 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.679 -0.26 . . . . 18.28 110.58 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.497 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 14.7 mm100 -78.25 150.77 77.65 Favored Pre-proline 0 C--N 1.321 -0.668 0 N-CA-C 108.445 -0.946 . . . . 15.48 108.445 178.167 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.616 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 74.5 Cg_exo -50.22 -43.17 44.43 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.468 2.112 . . . . 11.63 112.515 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -63.49 -22.51 66.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.001 -0.545 . . . . 13.31 112.099 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.497 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 36.5 mt-10 -74.9 -22.54 58.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.852 0.358 . . . . 17.34 110.922 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.656 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.9 mm? -98.14 -30.07 12.86 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.124 -0.489 . . . . 13.25 110.792 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 92.3 mt -62.77 108.28 1.14 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 12.99 111.217 -179.166 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 97.04 2.86 59.21 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.894 -0.67 . . . . 13.39 112.153 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.785 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 4.1 mmpt? -112.4 158.26 20.04 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 110.331 -0.248 . . . . 16.87 110.331 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.818 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 15.4 m120 -94.01 135.86 34.91 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.973 -0.38 . . . . 12.5 109.973 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.461 ' HB ' ' CZ ' ' A' ' 22' ' ' PHE . 13.8 tt -63.79 -27.34 42.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.014 0.435 . . . . 11.72 110.501 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 6.1 p -68.5 -17.72 22.47 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 116.086 -0.507 . . . . 12.89 111.392 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.818 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 34.9 mt-10 -78.49 -35.04 47.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.939 0.4 . . . . 16.53 111.143 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.459 ' HE2' ' HB3' ' A' ' 43' ' ' LYS . 48.8 m-85 -95.46 6.44 48.97 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.183 0.516 . . . . 15.34 110.752 -179.443 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 48.9 t -93.75 154.66 17.65 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.807 -0.633 . . . . 11.97 110.343 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.527 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 3.7 t-160 -62.43 128.44 91.37 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.647 -0.706 . . . . 14.67 109.512 179.178 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -44.6 -50.47 8.18 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 123.195 2.597 . . . . 15.15 114.25 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -73.1 -11.56 60.59 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.794 0.294 . . . . 16.47 111.794 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.527 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 5.5 m-20 -107.29 -0.16 22.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.863 0.363 . . . . 13.16 110.881 -179.371 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -60.89 -50.21 74.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.046 -0.524 . . . . 15.83 111.17 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -64.38 -36.05 82.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.786 0.327 . . . . 13.94 110.24 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 29.7 tp -58.1 -45.41 87.27 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.2 0.524 . . . . 12.11 109.744 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.429 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.4 OUTLIER -68.12 -47.23 68.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.481 -0.781 . . . . 9.71 109.984 179.041 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 36.9 ttt180 -54.26 -47.22 72.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.213 -0.903 . . . . 11.06 111.279 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -64.61 -43.86 92.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.133 -0.485 . . . . 9.71 110.924 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.7 m -60.04 -35.28 74.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.342 -0.39 . . . . 9.52 110.645 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.543 ' O ' HG12 ' A' ' 64' ' ' VAL . 7.4 m-85 -65.28 -46.09 81.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.321 -0.4 . . . . 11.4 110.19 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -66.27 -34.97 79.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.195 0.522 . . . . 10.04 109.944 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -63.87 -40.67 97.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.667 -0.697 . . . . 10.6 110.61 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.543 HG12 ' O ' ' A' ' 61' ' ' PHE . 0.4 OUTLIER -70.02 -25.63 28.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 116.564 -0.289 . . . . 10.62 110.872 -179.731 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 61' ' ' PHE . 75.5 t -69.03 -37.79 77.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 109.026 -0.731 . . . . 12.41 109.026 178.301 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 48.5 mtpt -76.5 -28.52 56.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.252 -0.886 . . . . 16.25 110.242 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.641 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 58.3 mt -71.71 -56.74 5.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.466 . . . . 12.66 110.79 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.417 ' HG3' ' O ' ' A' ' 65' ' ' VAL . 78.7 mttt 62.47 104.96 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 O-C-N 123.727 0.642 . . . . 14.83 112.315 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.04 -4.03 86.58 Favored Glycine 0 N--CA 1.454 -0.16 0 C-N-CA 120.716 -0.754 . . . . 9.8 112.942 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.641 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 7.1 tp-100 -101.53 130.31 47.78 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.67 -0.493 . . . . 9.59 109.67 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 2.7 p -83.29 107.26 14.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.288 0.566 . . . . 8.1 110.251 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 20.1 tp -100.08 110.98 23.28 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.996 -0.547 . . . . 7.8 110.312 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.441 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 0.0 OUTLIER -89.23 108.6 19.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.998 -0.546 . . . . 7.59 111.096 -179.612 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.428 HG13 ' HB ' ' A' ' 90' ' ' THR . 2.3 p -100.36 125.35 54.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.13 -0.486 . . . . 7.84 109.758 178.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 23.0 ttt -100.52 106.87 18.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.341 -0.391 . . . . 9.35 110.349 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.503 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 46.0 p90 -134.25 -174.47 3.56 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.815 -0.63 . . . . 9.66 110.159 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.491 ' HB2' ' HB2' ' A' ' 50' ' ' HIS . 47.4 mtt180 -105.08 117.14 33.25 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.184 -0.462 . . . . 13.1 110.195 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.503 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 11.4 t80 -107.03 147.6 29.74 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.019 -0.537 . . . . 9.28 109.888 -179.526 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.535 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 35.2 ttp180 -87.9 136.47 32.95 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.852 0.358 . . . . 10.87 110.885 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.417 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 66.0 p -96.52 -174.39 3.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.103 -0.499 . . . . 10.77 109.999 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.446 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 42.1 tptt -70.65 -14.25 62.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.346 0.593 . . . . 12.66 109.841 178.819 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -92.6 3.1 56.2 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.782 -0.644 . . . . 14.42 109.624 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 67.4 20.7 9.88 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.4 -0.818 . . . . 12.69 111.172 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.417 ' HG2' ' OG ' ' A' ' 80' ' ' SER . 3.2 pt-20 -96.07 153.47 17.76 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.357 -0.608 . . . . 10.85 109.357 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.535 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 67.1 m95 -100.29 112.17 24.49 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.892 0.377 . . . . 11.2 110.676 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.446 HD13 HD22 ' A' ' 112' ' ' ASN . 1.5 pp -110.02 156.04 21.04 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.241 -0.436 . . . . 11.12 110.643 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.513 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 82.5 m95 -81.67 114.65 20.48 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.197 0.523 . . . . 10.28 110.786 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 38.1 tpp -114.92 131.54 56.84 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.435 -0.802 . . . . 9.32 110.886 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.6 ttp180 -101.52 76.84 1.71 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.838 -0.801 . . . . 10.66 108.838 178.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.72 HG23 ' HB3' ' A' ' 108' ' ' CYS . 36.7 m -67.33 109.58 3.2 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.381 -0.827 . . . . 9.37 112.066 -178.798 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.441 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 0.7 OUTLIER -90.25 88.8 7.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.265 -0.879 . . . . 8.27 109.442 179.506 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.1 m -74.07 131.27 41.17 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.95 -0.568 . . . . 8.65 111.897 -178.565 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -130.3 122.43 27.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.878 -0.601 . . . . 11.56 110.176 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.26 119.24 18.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.402 -0.363 . . . . 10.16 111.388 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -101.52 106.97 18.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.942 0.401 . . . . 12.25 109.997 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -104.01 152.02 22.53 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.086 -0.506 . . . . 14.24 111.335 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.439 ' HB3' ' OE1' ' A' ' 102' ' ' GLU . 11.4 t-20 -86.3 133.03 41.4 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 108.79 -0.818 . . . . 13.83 108.79 178.553 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.62 14.4 0.41 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 122.81 2.34 . . . . 15.34 113.898 -178.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -87.29 -54.72 4.15 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.883 0.373 . . . . 16.89 110.294 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 18.8 m -142.38 19.91 2.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.142 -0.481 . . . . 14.89 110.179 178.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 18.4 t70 67.93 32.15 5.28 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.703 -0.681 . . . . 14.77 110.561 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' GLU . . . . . 0.439 ' OE1' ' HB3' ' A' ' 97' ' ' ASN . 1.6 mp0 -76.5 122.6 24.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.014 -0.539 . . . . 12.95 110.089 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 50.9 mt -70.57 108.56 2.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 109.993 -0.373 . . . . 11.11 109.993 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -72.78 -54.32 9.21 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.057 -0.52 . . . . 11.65 110.281 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -162.4 179.67 7.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.667 -0.697 . . . . 10.3 110.066 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 56.5 mt -115.64 117.89 57.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.222 -0.445 . . . . 10.29 110.468 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.604 HG21 HH22 ' B' ' 15' ' ' ARG . 33.4 mt -89.5 102.91 13.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.51 -0.552 . . . . 8.99 109.51 179.477 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.72 ' HB3' HG23 ' A' ' 90' ' ' THR . 99.5 m -97.15 112.69 24.36 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.227 0.537 . . . . 9.83 111.828 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.482 HG21 HG21 ' B' ' 13' ' ' ILE . 1.6 m -80.66 98.14 7.56 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 108.652 -0.87 . . . . 10.84 108.652 178.211 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.571 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 4.5 m-20 -80.55 99.84 8.29 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.148 -0.478 . . . . 11.26 111.544 -178.128 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.439 HG23 ' HB2' ' A' ' 11' ' ' GLU . 3.1 m -106.22 109.74 21.77 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.863 -0.608 . . . . 11.22 109.976 178.793 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ASN . . . . . 0.715 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 5.0 t-20 -75.19 134.88 41.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.881 0.372 . . . . 12.78 110.719 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.581 HG12 ' HG3' ' A' ' 114' ' ' LYS . 76.8 t -111.34 -50.55 6.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.91 -0.586 . . . . 14.64 109.9 179.388 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.581 ' HG3' HG12 ' A' ' 113' ' ' VAL . 61.3 mtpt . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.142 -0.932 . . . . 16.02 110.024 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 41.9 m . . . . . 0 N--CA 1.479 0.996 0 CA-C-O 121.05 0.453 . . . . 7.49 109.922 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 8' ' ' GLN . . . . . 0.468 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 26.4 mm-40 -124.88 135.94 27.38 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.287 -0.415 . . . . 7.12 110.604 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 9' ' ' PRO . . . . . 0.466 ' HD2' ' HG2' ' B' ' 28' ' ' ARG . 37.6 Cg_exo -61.06 154.8 54.49 Favored 'Trans proline' 0 CA--C 1.53 0.306 0 C-N-CA 122.763 2.308 . . . . 6.18 112.309 179.44 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.33 46.57 1.05 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.494 0.664 . . . . 5.81 110.654 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.635 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 62.3 tt0 -155.68 115.52 3.67 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.168 -0.923 . . . . 5.85 108.584 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 12' ' ' PHE . . . . . 0.654 ' HB3' ' HB2' ' B' ' 28' ' ' ARG . 33.9 p90 -137.23 155.99 48.84 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.505 0.557 . . . . 6.08 112.505 -178.353 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.495 HG13 HG23 ' B' ' 107' ' ' ILE . 3.4 tt -84.8 118.94 32.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.42 -0.809 . . . . 5.57 110.741 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.76 100.87 10.41 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.042 -0.527 . . . . 5.3 110.008 179.488 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 15' ' ' ARG . . . . . 0.604 HH22 HG21 ' A' ' 107' ' ' ILE . 9.4 mtp180 -88.88 105.1 17.52 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.882 -0.414 . . . . 8.97 109.882 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 34.5 p80 -131.71 155.94 46.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.952 -0.567 . . . . 8.31 110.217 -179.542 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -74.58 173.42 10.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.62 -0.264 . . . . 10.83 110.406 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.5 pt -56.78 -31.15 34.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 N-CA-C 112.846 0.684 . . . . 8.89 112.846 -178.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -71.15 -27.52 63.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.021 0.439 . . . . 11.92 111.254 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 117.82 -2.97 17.35 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.565 -0.826 . . . . 8.57 112.664 179.527 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 21' ' ' ILE . . . . . 0.406 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 19.3 mm -75.31 123.51 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 110.152 -0.314 . . . . 10.87 110.152 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 22' ' ' PHE . . . . . 0.542 ' CZ ' ' HB ' ' B' ' 45' ' ' ILE . 97.2 m-85 -74.74 130.65 39.87 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.877 0.37 . . . . 8.23 111.254 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 19.4 m -102.38 -39.95 6.94 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.982 -0.554 . . . . 7.91 110.309 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 24' ' ' PHE . . . . . 0.439 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 44.0 t80 -152.12 134.03 14.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.945 -0.57 . . . . 7.89 109.897 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 2.0 m -131.56 156.66 42.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.539 -0.301 . . . . 6.1 110.589 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 26' ' ' ASP . . . . . 0.555 ' HB3' ' HB2' ' B' ' 12' ' ' PHE . 11.8 t70 -81.95 158.98 23.7 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.04 -0.527 . . . . 7.15 110.466 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -67.92 -17.7 64.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.306 -0.406 . . . . 8.97 111.475 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 28' ' ' ARG . . . . . 0.654 ' HB2' ' HB3' ' B' ' 12' ' ' PHE . 65.5 mtm180 -62.98 -16.82 60.96 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.255 -0.429 . . . . 9.76 111.858 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 29.3 p -60.21 -36.3 77.36 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.749 0.309 . . . . 11.56 111.654 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 30' ' ' VAL . . . . . 0.477 ' O ' ' HA2' ' B' ' 34' ' ' GLY . 47.3 t -63.25 -31.42 52.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.972 -0.558 . . . . 13.64 111.34 -179.231 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -91.16 -21.09 21.34 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.809 0.338 . . . . 12.9 111.308 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 26.0 m -82.92 -57.05 3.46 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.066 0.395 . . . . 12.13 112.066 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 33' ' ' VAL . . . . . 0.553 HG11 ' HD2' ' B' ' 78' ' ' PHE . 0.2 OUTLIER -117.31 -11.68 11.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 111.83 0.307 . . . . 13.87 111.83 -179.391 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 34' ' ' GLY . . . . . 0.477 ' HA2' ' O ' ' B' ' 30' ' ' VAL . . . 90.01 -0.82 79.57 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.506 -0.854 . . . . 13.79 112.364 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 -79.57 132.51 36.31 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.654 0.264 . . . . 15.38 111.033 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 36' ' ' GLN . . . . . 0.456 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 80.8 mm-40 -76.6 147.12 77.96 Favored Pre-proline 0 C--N 1.321 -0.674 0 N-CA-C 107.993 -1.114 . . . . 13.78 107.993 177.823 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.632 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 72.5 Cg_exo -49.86 -39.93 48.66 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.561 2.174 . . . . 14.71 112.878 -179.357 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -66.93 -17.03 64.72 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.914 -0.584 . . . . 17.54 112.531 -179.088 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.456 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 33.2 mt-10 -78.74 -32.21 46.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.885 0.374 . . . . 14.24 110.648 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' B' ' 22' ' ' PHE . 1.8 mm? -82.88 -30.7 28.34 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.067 -0.515 . . . . 14.03 110.985 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.632 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 58.8 mt -61.7 104.8 0.47 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.253 -0.43 . . . . 13.62 111.668 -179.114 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 100.69 5.81 53.38 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.85 -0.69 . . . . 11.62 112.85 179.377 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.666 ' HE2' ' HA ' ' B' ' 43' ' ' LYS . 6.1 mmpt? -118.85 157.31 27.86 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.612 0.244 . . . . 13.82 110.68 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 44' ' ' ASN . . . . . 0.791 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 18.8 m120 -93.4 137.1 33.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.235 -0.438 . . . . 10.16 110.177 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 45' ' ' ILE . . . . . 0.542 ' HB ' ' CZ ' ' B' ' 22' ' ' PHE . 14.1 tt -59.69 -29.42 42.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.143 0.497 . . . . 9.62 110.952 179.44 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 46' ' ' VAL . . . . . 0.422 HG12 ' HB3' ' B' ' 44' ' ' ASN . 7.9 p -69.63 -20.91 24.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.991 -0.549 . . . . 11.5 111.401 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 47' ' ' GLU . . . . . 0.791 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 38.6 mt-10 -74.15 -20.78 60.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.926 0.393 . . . . 11.89 110.935 -179.56 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 48' ' ' PHE . . . . . 0.407 ' HB2' ' CZ ' ' B' ' 78' ' ' PHE . 40.6 m-85 -112.04 18.87 18.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.101 0.477 . . . . 13.6 109.906 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 51.9 t -102.88 151.62 22.23 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.818 -0.628 . . . . 10.81 110.636 -179.501 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 50' ' ' HIS . . . . . 0.611 ' HB3' ' HB2' ' B' ' 53' ' ' ASP . 5.0 t-80 -57.36 130.22 80.56 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.835 -0.62 . . . . 11.49 109.472 178.767 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -46.49 -45.77 18.66 Favored 'Trans proline' 0 CA--C 1.534 0.481 0 C-N-CA 123.048 2.499 . . . . 11.35 113.587 -179.14 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -82.34 6.55 16.66 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.138 0.421 . . . . 9.28 112.138 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 53' ' ' ASP . . . . . 0.611 ' HB2' ' HB3' ' B' ' 50' ' ' HIS . 5.2 m-20 -125.1 -0.7 7.78 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.033 0.444 . . . . 7.52 110.498 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -64.4 -46.88 81.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.835 -0.62 . . . . 6.57 111.102 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 49.2 tp60 -61.51 -42.16 98.38 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.108 -0.497 . . . . 6.58 110.402 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 65.4 tp -59.44 -42.09 91.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.081 -0.509 . . . . 4.6 110.28 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.41 HD22 ' CZ ' ' B' ' 61' ' ' PHE . 0.5 OUTLIER -62.87 -49.95 72.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.089 -0.505 . . . . 6.4 110.043 179.356 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -58.18 -46.04 86.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.435 -0.802 . . . . 8.18 111.239 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -62.7 -38.69 91.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.095 -0.502 . . . . 6.07 111.197 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 31.0 m -68.74 -36.79 78.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.149 -0.478 . . . . 5.59 110.982 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 61' ' ' PHE . . . . . 0.593 ' O ' HG12 ' B' ' 64' ' ' VAL . 8.2 m-85 -62.51 -46.46 88.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.759 0.314 . . . . 7.73 110.738 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -67.04 -27.69 67.6 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.933 0.397 . . . . 6.89 110.555 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.543 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 18.2 mt-30 -72.53 -42.06 65.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.048 -0.524 . . . . 9.4 110.933 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.593 HG12 ' O ' ' B' ' 61' ' ' PHE . 3.2 p -66.04 -25.13 35.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.802 0.334 . . . . 7.57 110.31 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 65' ' ' VAL . . . . . 0.5 HG23 ' O ' ' B' ' 61' ' ' PHE . 89.3 t -72.22 -32.56 43.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 109.264 -0.643 . . . . 7.43 109.264 178.379 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -71.84 -34.72 69.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.65 -0.704 . . . . 10.21 110.182 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' B' ' 63' ' ' GLN . 24.3 mt -68.94 -51.18 42.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.772 -0.649 . . . . 7.2 109.975 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 31.1 mttt 59.44 102.31 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 O-C-N 124.12 0.887 . . . . 7.58 112.383 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.63 16.61 54.62 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.649 -0.786 . . . . 5.57 112.328 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -126.45 162.16 26.25 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 110.275 -0.269 . . . . 5.43 110.275 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 71' ' ' VAL . . . . . 0.4 ' HA ' ' O ' ' B' ' 92' ' ' SER . 24.8 t -106.88 121.09 59.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.342 -0.39 . . . . 5.65 111.125 -179.017 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 21.2 tp -115.81 104.09 11.3 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.216 -0.661 . . . . 4.51 109.216 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 73' ' ' SER . . . . . 0.476 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.4 m -86.21 117.97 25.37 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.908 -0.587 . . . . 6.35 111.032 -179.24 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.7 p -103.86 129.05 56.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.024 -0.534 . . . . 4.34 110.21 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 10.7 tpt -100.47 117.1 33.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.124 -0.489 . . . . 5.42 110.362 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -154.31 -171.91 4.03 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.393 -0.367 . . . . 3.54 110.205 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 77' ' ' ARG . . . . . 0.597 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 11.8 mtm180 -108.59 119.33 39.19 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.961 0.41 . . . . 6.8 110.62 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.553 ' HD2' HG11 ' B' ' 33' ' ' VAL . 19.5 t80 -102.38 144.78 30.43 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.482 -0.781 . . . . 5.79 110.03 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 79' ' ' ARG . . . . . 0.562 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 35.7 ttp180 -80.34 136.54 36.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.725 0.298 . . . . 11.08 110.517 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 80' ' ' SER . . . . . 0.556 ' OG ' ' HG2' ' B' ' 84' ' ' GLU . 88.9 p -99.26 -176.34 3.27 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.866 -0.42 . . . . 7.47 109.866 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 81' ' ' LYS . . . . . 0.425 ' HA ' ' HD2' ' B' ' 81' ' ' LYS . 32.2 tptt -70.19 -10.42 58.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.566 0.698 . . . . 12.24 109.688 178.762 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 33.2 m-20 -96.39 3.49 52.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.416 -0.811 . . . . 9.25 109.796 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 67.49 17.5 10.04 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.511 -0.768 . . . . 8.3 111.327 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 84' ' ' GLU . . . . . 0.556 ' HG2' ' OG ' ' B' ' 80' ' ' SER . 7.1 pt-20 -94.91 158.94 15.26 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.236 -0.653 . . . . 6.78 109.236 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 85' ' ' TRP . . . . . 0.597 ' HB3' ' HB3' ' B' ' 77' ' ' ARG . 42.2 m95 -106.48 108.65 20.27 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 121.03 -0.268 . . . . 7.89 110.631 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' B' ' 77' ' ' ARG . 1.9 pp -105.57 152.68 22.77 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.345 -0.388 . . . . 6.97 110.129 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 87' ' ' TRP . . . . . 0.79 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 95.1 m95 -80.88 120.32 24.56 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.034 0.445 . . . . 8.55 110.835 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 2.0 ttp -132.0 140.48 48.95 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.929 -0.578 . . . . 4.46 110.889 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 28.5 ttp180 -103.01 93.89 5.26 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.776 -0.647 . . . . 6.87 109.36 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 90' ' ' THR . . . . . 0.545 ' CG2' ' HB3' ' B' ' 108' ' ' CYS . 6.4 m -78.47 105.37 9.69 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.014 -0.539 . . . . 6.18 111.281 -179.319 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 91' ' ' SER . . . . . 0.476 ' HA ' ' HA ' ' B' ' 73' ' ' SER . 0.9 OUTLIER -84.05 94.86 8.41 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.65 -0.704 . . . . 6.3 109.973 179.657 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 92' ' ' SER . . . . . 0.4 ' O ' ' HA ' ' B' ' 71' ' ' VAL . 8.6 m -84.73 127.18 33.98 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.366 -0.379 . . . . 6.65 111.939 -178.484 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -125.24 131.0 53.2 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.21 -0.45 . . . . 6.45 109.904 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 94' ' ' THR . . . . . 0.446 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.0 OUTLIER -89.28 114.36 25.72 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.472 -0.331 . . . . 9.17 110.797 179.644 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -102.45 122.81 45.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.917 0.389 . . . . 8.33 110.423 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -106.6 147.65 29.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.968 -0.56 . . . . 10.53 110.533 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 97' ' ' ASN . . . . . 0.432 ' HB3' ' CD2' ' B' ' 99' ' ' TYR . 3.4 m-80 -85.11 147.25 47.26 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 115.972 -0.558 . . . . 8.43 110.221 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -78.61 49.83 3.21 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.8 2.333 . . . . 9.16 112.999 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 99' ' ' TYR . . . . . 0.432 ' CD2' ' HB3' ' B' ' 97' ' ' ASN . 51.3 m-85 -128.71 -58.14 1.17 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.999 0.428 . . . . 11.34 110.366 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.13 21.01 2.8 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.191 -0.459 . . . . 7.75 110.538 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 32.7 t70 62.83 32.76 15.7 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.779 0.8 . . . . 9.08 110.005 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -85.7 140.42 30.54 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.481 -0.781 . . . . 7.71 110.783 -179.401 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 25.5 mt -84.94 117.74 30.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.322 -0.399 . . . . 8.04 110.028 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -75.7 -46.37 31.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.909 0.385 . . . . 8.81 110.045 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -165.49 172.48 12.05 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.796 -0.638 . . . . 7.4 109.643 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 54.3 mt -106.37 115.89 48.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 109.952 -0.388 . . . . 6.78 109.952 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.495 HG23 HG13 ' B' ' 13' ' ' ILE . 77.0 mt -81.9 105.55 11.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.753 -0.658 . . . . 6.31 109.741 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 108' ' ' CYS . . . . . 0.545 ' HB3' ' CG2' ' B' ' 90' ' ' THR . 94.4 m -107.85 99.0 8.51 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 120.863 0.363 . . . . 5.31 111.948 -179.101 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 94.4 m -75.64 105.54 6.73 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.413 -0.958 . . . . 5.48 108.413 177.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 110' ' ' ASN . . . . . 0.634 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 3.7 m-20 -81.85 101.18 10.03 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.718 -0.674 . . . . 6.9 111.671 -178.108 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 20.4 m -101.56 107.43 18.71 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.814 -0.63 . . . . 8.61 110.301 179.28 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 112' ' ' ASN . . . . . 0.424 HD22 HD13 ' B' ' 86' ' ' LEU . 8.9 t-20 -70.86 135.76 48.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.787 0.327 . . . . 11.84 110.502 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 37.1 t -113.37 -53.46 5.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.005 -0.543 . . . . 11.77 110.009 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 114' ' ' LYS . . . . . 0.79 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 46.4 mtpt . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.283 -0.865 . . . . 12.68 109.817 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 78.6 mm-40 . . . . . 0 N--CA 1.453 -0.301 0 N-CA-C 109.582 -0.525 . . . . 15.08 109.582 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -61.12 150.83 82.5 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 123.089 2.526 . . . . 13.43 112.32 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.812 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.0 OUTLIER -82.96 51.39 1.92 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.27 0.557 . . . . 11.09 110.8 -179.861 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.632 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 30.7 tt0 -153.71 116.26 4.42 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.602 -0.888 . . . . 10.59 108.602 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.998 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 41.3 p90 -130.95 166.39 21.07 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.984 0.421 . . . . 8.93 111.579 -178.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.559 HD13 HG23 ' A' ' 109' ' ' THR . 30.9 mm -94.77 121.28 45.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.854 -0.612 . . . . 8.66 110.665 -179.723 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.626 ' HB3' ' HE2' ' A' ' 22' ' ' PHE . 0.7 OUTLIER -106.54 97.1 6.93 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.159 -0.473 . . . . 6.11 110.878 179.588 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.439 ' HB2' ' HB3' ' A' ' 24' ' ' PHE . 3.5 mtt180 -83.17 102.41 11.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.763 -0.829 . . . . 9.09 108.763 178.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.446 ' O ' ' HB2' ' A' ' 105' ' ' TYR . 34.4 p80 -132.18 158.7 41.03 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 121.149 -0.22 . . . . 9.79 111.265 -178.555 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -77.92 178.23 7.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.487 -0.324 . . . . 12.69 110.235 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 22.2 pt -54.55 -37.04 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 113.374 0.879 . . . . 13.58 113.374 -178.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -73.17 -25.66 60.88 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.039 0.447 . . . . 13.85 111.568 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 116.35 1.09 20.39 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.449 -0.882 . . . . 9.38 112.198 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.434 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 37.0 mm -67.89 114.37 4.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 109.728 -0.471 . . . . 10.74 109.728 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.626 ' HE2' ' HB3' ' A' ' 14' ' ' SER . 78.8 m-85 -67.32 126.27 28.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.143 -0.48 . . . . 9.73 110.907 -179.703 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.2 m -106.29 -26.02 11.7 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.68 -0.691 . . . . 7.74 109.754 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' PHE . . . . . 0.46 ' HE2' ' HE1' ' B' ' 95' ' ' PHE . 78.1 t80 -152.42 116.2 4.83 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.646 -0.706 . . . . 6.92 109.615 179.273 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.604 HG21 ' HB2' ' A' ' 40' ' ' LEU . 19.3 t -112.27 127.48 69.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.347 -0.388 . . . . 6.02 110.763 -179.509 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.998 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 10.1 t70 -66.38 136.28 55.54 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.145 -0.48 . . . . 7.31 110.08 179.4 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -57.61 -16.3 9.99 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.896 0.702 . . . . 11.67 112.896 -179.045 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.472 ' HB2' ' HB3' ' A' ' 12' ' ' PHE . 80.1 mtm180 -67.95 -10.57 54.51 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.216 -0.302 . . . . 11.91 111.077 179.38 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 29.1 p -59.89 -31.46 69.82 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.726 0.298 . . . . 12.99 110.914 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 20.4 t -65.01 -36.55 78.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.185 -0.461 . . . . 16.15 110.823 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.05 -16.27 38.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.933 0.397 . . . . 15.07 110.922 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.79 ' HA ' HG22 ' A' ' 10' ' ' THR . 25.8 m -87.97 -56.64 3.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.019 -0.537 . . . . 14.9 111.594 -179.579 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.65 ' HB ' ' HA ' ' A' ' 80' ' ' SER . 7.7 m -121.47 -19.41 4.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 111.924 0.342 . . . . 13.84 111.924 -179.49 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.2 -18.27 56.82 Favored Glycine 0 N--CA 1.454 -0.145 0 C-N-CA 120.602 -0.809 . . . . 13.85 112.273 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.461 ' H ' HG23 ' A' ' 33' ' ' VAL . 5.7 m-85 -66.37 136.92 56.46 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.624 0.249 . . . . 18.28 110.483 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.481 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 15.2 mm100 -76.24 150.6 83.01 Favored Pre-proline 0 C--N 1.326 -0.437 0 N-CA-C 109.37 -0.604 . . . . 15.48 109.37 179.207 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.537 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 52.6 Cg_exo -52.47 -41.97 64.27 Favored 'Trans proline' 0 CA--C 1.527 0.162 0 C-N-CA 122.529 2.153 . . . . 11.63 112.528 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.487 ' HA ' HD12 ' A' ' 41' ' ' LEU . 23.4 mp0 -69.24 -19.19 63.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.025 -0.534 . . . . 13.31 111.839 -179.174 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.481 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 36.7 mt-10 -73.45 -24.05 60.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.945 0.402 . . . . 17.34 110.426 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.604 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.8 mm? -93.45 -28.49 16.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.071 -0.513 . . . . 13.25 110.286 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 91.8 mt -61.17 131.8 51.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.925 -0.579 . . . . 12.99 110.772 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 75.99 11.72 84.54 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.928 -0.653 . . . . 13.39 112.681 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.783 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 7.9 mmpt? -129.47 159.61 35.74 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.696 0.284 . . . . 16.87 110.388 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.4 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 13.3 m120 -94.02 138.23 32.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.157 -0.474 . . . . 12.5 110.197 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.41 HG13 ' HE1' ' A' ' 78' ' ' PHE . 17.2 tt -60.25 -25.7 34.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.013 -0.539 . . . . 11.72 111.3 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.8 p -68.38 -20.84 25.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 116.342 -0.39 . . . . 12.89 111.413 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.4 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 39.1 mt-10 -76.99 -23.62 52.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.048 0.451 . . . . 16.53 110.4 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -106.11 15.09 26.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.885 -0.598 . . . . 15.34 109.984 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 17.1 t -106.62 147.98 28.86 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.461 -0.79 . . . . 11.97 110.843 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.415 ' CD2' ' HD2' ' A' ' 51' ' ' PRO . 7.4 t-160 -57.76 127.76 79.19 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 115.58 -0.736 . . . . 14.67 109.36 178.782 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.415 ' HD2' ' CD2' ' A' ' 50' ' ' HIS . 80.7 Cg_exo -45.18 -52.17 6.82 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.475 2.783 . . . . 15.15 113.976 -179.136 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -67.67 -8.91 38.77 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.315 0.487 . . . . 16.47 112.315 -179.483 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.542 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 27.8 m-20 -114.84 -1.48 13.18 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.793 0.33 . . . . 13.16 110.893 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.402 ' OE1' ' HA ' ' A' ' 51' ' ' PRO . 83.5 mt-30 -62.39 -46.2 89.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.24 -0.436 . . . . 15.83 111.099 -179.468 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -63.01 -38.19 90.19 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.64 -0.504 . . . . 13.94 109.64 178.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.3 tp -61.7 -43.35 99.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.626 -0.716 . . . . 12.11 109.925 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.438 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.3 OUTLIER -63.99 -52.52 59.2 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.781 -0.645 . . . . 9.71 110.706 179.487 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 33.6 ttt180 -58.22 -46.3 86.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.319 -0.4 . . . . 11.06 111.385 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.473 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 34.7 t70 -61.5 -45.58 93.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.71 -0.223 . . . . 9.71 110.914 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 45.2 m -63.61 -37.53 87.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.972 0.415 . . . . 9.52 110.557 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.5 ' O ' HG23 ' A' ' 65' ' ' VAL . 2.8 m-30 -63.3 -37.33 86.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.106 -0.497 . . . . 11.4 109.993 178.841 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 92.9 mm-40 -73.32 -33.06 64.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.182 -0.463 . . . . 10.04 109.92 178.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.473 ' HG3' ' O ' ' A' ' 59' ' ' ASP . 52.9 mt-30 -63.53 -45.33 91.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.878 -0.601 . . . . 10.6 110.991 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.499 HG12 ' O ' ' A' ' 61' ' ' PHE . 6.3 p -65.29 -25.23 36.71 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-N 116.538 -0.301 . . . . 10.62 111.472 -179.231 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 61' ' ' PHE . 79.5 t -70.82 -32.77 50.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 109.405 -0.591 . . . . 12.41 109.405 178.801 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 34.8 mtpt -82.56 -18.31 41.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.43 -0.805 . . . . 16.25 110.245 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 92.1 mt -83.03 -54.16 5.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.012 -0.54 . . . . 12.66 109.967 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 57.6 mttt 61.4 94.98 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.914 0.759 . . . . 14.83 112.814 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 107.17 -25.48 21.87 Favored Glycine 0 N--CA 1.454 -0.109 0 C-N-CA 120.423 -0.894 . . . . 9.8 113.753 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -90.33 131.54 36.07 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.156 -0.313 . . . . 9.59 110.156 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.46 ' HB ' ' HZ ' ' B' ' 24' ' ' PHE . 3.7 p -77.54 113.07 16.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.269 0.557 . . . . 8.1 110.491 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 33.3 tp -102.19 100.16 10.34 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.038 -0.528 . . . . 7.8 110.602 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.429 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 0.0 OUTLIER -81.66 115.01 20.72 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.607 -0.724 . . . . 7.59 110.363 179.478 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 p -109.52 122.95 64.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.915 0.388 . . . . 7.84 110.172 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 27.7 ttt -97.17 111.96 23.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.261 -0.427 . . . . 9.35 111.065 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.542 ' HB2' ' HB3' ' A' ' 53' ' ' ASP . 48.3 p90 -140.49 -173.47 3.69 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.195 -0.669 . . . . 9.66 109.195 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.455 ' HB3' ' HB3' ' A' ' 85' ' ' TRP . 12.9 mtm180 -105.59 122.17 45.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.105 0.479 . . . . 13.1 110.649 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.41 ' HE1' HG13 ' A' ' 45' ' ' ILE . 23.1 t80 -104.27 152.61 22.01 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.671 -0.695 . . . . 9.28 110.203 -179.124 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.616 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 46.9 ttp180 -92.83 128.43 38.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.871 0.367 . . . . 10.87 111.018 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.65 ' HA ' ' HB ' ' A' ' 33' ' ' VAL . 77.5 p -90.76 -176.63 4.75 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.698 -0.482 . . . . 10.77 109.698 179.117 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.443 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 40.3 tptt -71.41 -12.2 61.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.376 0.608 . . . . 12.66 109.614 178.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -90.84 2.98 55.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.404 -0.816 . . . . 14.42 109.342 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 65.24 23.72 12.22 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 115.029 -0.987 . . . . 12.69 111.104 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.494 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.6 pt-20 -99.2 160.15 14.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 10.85 109.888 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.616 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 64.8 m95 -106.47 110.66 22.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.521 -0.309 . . . . 11.2 110.638 -179.563 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.432 ' H ' ' HG ' ' A' ' 86' ' ' LEU . 0.8 OUTLIER -113.72 154.94 26.47 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.264 -0.426 . . . . 11.12 110.072 179.643 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.437 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 97.9 m95 -75.04 120.5 20.65 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.247 0.546 . . . . 10.28 111.416 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 47.8 tpp -119.44 130.71 55.4 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.221 -0.9 . . . . 9.32 110.416 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.515 ' HB3' ' HB ' ' A' ' 111' ' ' THR . 3.1 ttp180 -101.87 73.97 1.44 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.042 -0.725 . . . . 10.66 109.042 178.699 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.644 HG23 ' HB3' ' A' ' 108' ' ' CYS . 52.3 m -64.34 114.43 4.27 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.694 -0.685 . . . . 9.37 111.651 -179.242 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.595 ' O ' ' HA ' ' A' ' 108' ' ' CYS . 0.7 OUTLIER -89.75 94.45 9.84 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.385 -0.825 . . . . 8.27 109.873 179.948 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.431 ' HA ' ' SG ' ' A' ' 108' ' ' CYS . 5.3 m -77.5 117.45 18.96 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.982 0.42 . . . . 8.65 111.532 -179.057 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -122.91 117.55 25.82 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.837 -0.619 . . . . 11.56 109.77 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.56 127.75 33.6 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.227 -0.442 . . . . 10.16 111.664 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -104.03 118.53 36.89 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.586 -0.524 . . . . 12.25 109.586 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -108.54 149.17 29.22 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.215 0.531 . . . . 14.24 111.928 -178.603 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.47 ' HA ' ' HD3' ' A' ' 98' ' ' PRO . 12.0 t-20 -97.19 132.89 24.75 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 115.36 -0.836 . . . . 13.83 109.612 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' A' ' 97' ' ' ASN . 27.5 Cg_exo -63.27 -6.31 9.74 Favored 'Trans proline' 0 N--CA 1.476 0.486 0 C-N-CA 123.358 2.705 . . . . 15.34 114.467 -178.612 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -62.84 -61.51 2.36 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.643 0.258 . . . . 16.89 110.436 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -145.31 27.95 1.23 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.736 0.303 . . . . 14.89 111.0 179.096 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 27.7 t70 63.52 41.9 7.0 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.529 -0.759 . . . . 14.77 111.782 179.202 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -91.36 142.47 27.65 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.351 -0.386 . . . . 12.95 110.067 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 48.9 mt -88.75 102.3 12.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.047 -0.353 . . . . 11.11 110.047 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.482 ' H ' ' HG2' ' A' ' 104' ' ' GLU . 2.5 pt-20 -71.26 -41.37 70.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.71 0.291 . . . . 11.65 110.974 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.446 ' HB2' ' O ' ' A' ' 16' ' ' HIS . 20.6 p90 -161.6 178.96 8.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.777 0.322 . . . . 10.3 110.642 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 44.4 mt -122.24 123.24 68.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.092 -0.504 . . . . 10.29 110.634 -179.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.626 HG21 HH22 ' B' ' 15' ' ' ARG . 85.8 mt -91.12 112.7 25.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.11 -0.7 . . . . 8.99 109.11 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.644 ' HB3' HG23 ' A' ' 90' ' ' THR . 96.8 m -113.76 116.59 29.63 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.372 0.508 . . . . 9.83 112.372 -178.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.559 HG23 HD13 ' A' ' 13' ' ' ILE . 0.2 OUTLIER -82.92 110.55 18.0 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.69 -0.856 . . . . 10.84 108.69 177.865 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.632 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 3.9 m-20 -85.56 98.33 10.58 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.882 0.372 . . . . 11.26 111.448 -178.23 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.515 ' HB ' ' HB3' ' A' ' 89' ' ' ARG . 1.3 m -93.75 110.55 22.18 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.756 -0.657 . . . . 11.22 111.165 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ASN . . . . . 0.812 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 3.8 t-20 -75.64 111.93 11.48 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.588 -0.523 . . . . 12.78 109.588 178.719 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' VAL . . . . . 0.486 HG12 ' HG3' ' A' ' 114' ' ' LYS . 39.5 t -91.4 -53.41 8.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 116.072 -0.513 . . . . 14.64 110.488 -179.578 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.486 ' HG3' HG12 ' A' ' 113' ' ' VAL . 54.7 mtpt . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.406 -0.806 . . . . 16.02 110.056 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 18.8 m . . . . . 0 N--CA 1.478 0.96 0 CA-C-O 120.716 0.294 . . . . 7.49 110.295 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 8' ' ' GLN . . . . . 0.749 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 33.5 mm-40 -75.81 146.18 79.24 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.386 -0.37 . . . . 7.12 110.94 -179.362 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 9' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' B' ' 8' ' ' GLN . 5.5 Cg_exo -80.54 -167.41 0.5 Allowed 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 123.276 2.651 . . . . 6.18 112.812 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 10' ' ' THR . . . . . 0.738 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.1 OUTLIER -99.32 47.04 0.96 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.218 0.532 . . . . 5.81 110.936 -179.707 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.503 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -151.76 151.53 31.51 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.543 -0.91 . . . . 5.85 108.543 179.593 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 12' ' ' PHE . . . . . 0.631 ' HB2' ' HB3' ' B' ' 26' ' ' ASP . 18.8 p90 -161.32 158.72 27.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.412 0.625 . . . . 6.08 112.019 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.539 HG13 HG21 ' A' ' 109' ' ' THR . 24.7 mm -85.51 118.81 32.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.091 -0.959 . . . . 5.57 110.542 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.443 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.8 OUTLIER -112.79 89.2 3.01 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.199 -0.455 . . . . 5.3 110.761 179.9 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 15' ' ' ARG . . . . . 0.626 HH22 HG21 ' A' ' 107' ' ' ILE . 8.1 mtp180 -83.4 110.83 18.48 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.387 -0.597 . . . . 8.97 109.387 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 16' ' ' HIS . . . . . 0.522 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 33.6 p80 -136.68 162.53 32.9 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.548 -0.296 . . . . 8.31 110.616 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -78.14 174.97 10.59 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.208 -0.293 . . . . 10.83 110.208 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 27.0 pt -59.71 -24.11 28.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 113.109 0.781 . . . . 8.89 113.109 -178.694 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -77.54 -22.01 51.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.935 0.398 . . . . 11.92 110.981 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 112.72 -7.82 25.94 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.558 -0.83 . . . . 8.57 112.368 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 33.9 mm -69.71 116.71 11.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 110.186 -0.301 . . . . 10.87 110.186 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 22' ' ' PHE . . . . . 0.522 ' HA ' ' HB3' ' B' ' 16' ' ' HIS . 94.7 m-85 -66.13 121.4 15.07 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.091 -0.504 . . . . 8.23 111.106 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -92.19 -40.25 11.11 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.779 -0.646 . . . . 7.91 110.363 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 24' ' ' PHE . . . . . 0.46 ' HZ ' ' HB ' ' A' ' 71' ' ' VAL . 47.6 t80 -155.44 120.87 4.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.101 -0.499 . . . . 7.89 110.29 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 10.6 m -115.86 154.68 17.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.032 0.444 . . . . 6.1 111.218 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 26' ' ' ASP . . . . . 0.631 ' HB3' ' HB2' ' B' ' 12' ' ' PHE . 9.2 t70 -74.47 165.03 25.88 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.428 -0.806 . . . . 7.15 110.233 179.48 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 4.2 m170 -82.27 -8.7 59.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.838 0.352 . . . . 8.97 110.981 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 28' ' ' ARG . . . . . 0.749 ' HG2' ' HB3' ' B' ' 8' ' ' GLN . 72.1 mtm180 -69.1 -14.62 63.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.006 -0.543 . . . . 9.76 111.974 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 28.4 p -57.28 -31.66 65.84 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 111.725 0.269 . . . . 11.56 111.725 -178.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 25.1 t -63.05 -38.74 82.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.205 -0.452 . . . . 13.64 111.108 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.04 -17.57 30.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.771 0.32 . . . . 12.9 110.968 179.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 41.5 m -80.39 -58.82 2.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.167 -0.47 . . . . 12.13 111.849 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 33' ' ' VAL . . . . . 0.505 ' HB ' ' HA ' ' B' ' 80' ' ' SER . 3.5 m -127.68 -2.07 3.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 112.24 0.459 . . . . 13.87 112.24 -178.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.29 -19.94 28.85 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.705 -0.759 . . . . 13.79 112.564 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 35' ' ' TYR . . . . . 0.442 ' HB2' HG23 ' B' ' 33' ' ' VAL . 4.2 m-85 -62.95 129.63 41.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.708 0.29 . . . . 15.38 110.668 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 36' ' ' GLN . . . . . 0.588 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 17.9 mm100 -73.74 151.89 89.1 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 109.54 -0.541 . . . . 13.78 109.54 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.504 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 61.3 Cg_exo -51.58 -38.86 65.85 Favored 'Trans proline' 0 CA--C 1.53 0.32 0 C-N-CA 122.757 2.304 . . . . 14.71 112.778 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 24.3 mp0 -71.44 -13.38 61.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.883 -0.599 . . . . 17.54 111.821 -179.203 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.588 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 30.4 mt-10 -85.14 -19.8 31.24 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.8 0.333 . . . . 14.24 110.293 179.591 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -92.24 -45.1 8.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.016 -0.538 . . . . 14.03 110.377 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 51.5 mt -58.56 126.39 27.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.009 -0.541 . . . . 13.62 111.211 -179.249 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.53 -5.16 83.99 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.778 -0.646 . . . . 11.62 112.261 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.804 ' HE2' ' HA ' ' B' ' 43' ' ' LYS . 6.7 mmpt? -112.05 160.05 17.87 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 122.758 -0.26 . . . . 13.82 110.433 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 44' ' ' ASN . . . . . 0.826 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 17.7 m120 -92.61 138.12 31.78 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.601 -0.518 . . . . 10.16 109.601 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 45' ' ' ILE . . . . . 0.438 ' HB ' ' CZ ' ' B' ' 22' ' ' PHE . 14.4 tt -62.9 -28.07 44.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.034 0.445 . . . . 9.62 111.055 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 5.1 p -71.5 -18.64 20.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-N 116.224 -0.444 . . . . 11.5 111.72 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 47' ' ' GLU . . . . . 0.826 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 42.9 mt-10 -69.57 -37.41 76.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.902 0.382 . . . . 11.89 110.968 -179.344 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 -98.74 18.19 17.53 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.023 0.439 . . . . 13.6 110.405 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 41.1 t -101.65 145.67 28.77 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.888 -0.596 . . . . 10.81 110.616 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 50' ' ' HIS . . . . . 0.482 ' CD2' ' HD2' ' B' ' 51' ' ' PRO . 5.5 t-160 -55.64 128.61 69.32 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.537 -0.756 . . . . 11.49 109.92 178.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 51' ' ' PRO . . . . . 0.482 ' HD2' ' CD2' ' B' ' 50' ' ' HIS . 95.7 Cg_exo -44.57 -51.72 6.81 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 123.516 2.811 . . . . 11.35 113.628 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -70.07 -4.19 19.98 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.184 0.439 . . . . 9.28 112.184 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 53' ' ' ASP . . . . . 0.435 ' HB3' ' HB2' ' B' ' 76' ' ' PHE . 53.5 m-20 -120.54 -0.32 10.32 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.866 0.365 . . . . 7.52 110.502 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -62.72 -43.51 98.62 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.97 -0.559 . . . . 6.57 111.209 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 48.6 tp60 -69.41 -39.31 77.97 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.425 -0.352 . . . . 6.58 110.189 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 58.0 tp -59.64 -39.81 85.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 4.6 110.483 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.42 HD22 ' CZ ' ' B' ' 61' ' ' PHE . 0.7 OUTLIER -62.85 -50.42 71.0 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.003 -0.544 . . . . 6.4 110.33 179.267 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 52.8 ttt180 -61.43 -43.45 98.85 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.103 -0.499 . . . . 8.18 110.923 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 59' ' ' ASP . . . . . 0.444 ' O ' ' HG3' ' B' ' 63' ' ' GLN . 25.3 t70 -60.0 -46.52 89.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.812 0.339 . . . . 6.07 110.296 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 36.6 m -61.42 -34.2 74.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.959 -0.564 . . . . 5.59 110.426 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 61' ' ' PHE . . . . . 0.49 ' O ' HG12 ' B' ' 64' ' ' VAL . 10.7 m-85 -65.35 -39.8 92.82 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.295 0.569 . . . . 7.73 109.535 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -67.4 -35.55 79.52 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.802 -0.636 . . . . 6.89 110.171 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' B' ' 59' ' ' ASP . 34.8 mt-30 -69.28 -44.51 71.69 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.941 -0.572 . . . . 9.4 111.514 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.56 ' HA ' HD12 ' B' ' 67' ' ' LEU . 9.9 p -63.49 -29.22 46.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-O 120.719 0.295 . . . . 7.57 110.692 -179.468 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 65' ' ' VAL . . . . . 0.686 ' HA ' HG21 ' B' ' 94' ' ' THR . 61.3 t -70.44 -35.48 62.24 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.1 0 N-CA-C 109.638 -0.505 . . . . 7.43 109.638 178.539 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -67.66 -39.97 84.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.843 -0.617 . . . . 10.21 110.039 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.56 HD12 ' HA ' ' B' ' 64' ' ' VAL . 25.6 mt -66.17 -49.0 68.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.564 -0.744 . . . . 7.2 110.082 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 14.6 tttt 60.75 98.41 0.03 OUTLIER 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.474 -0.785 . . . . 7.58 112.228 179.314 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.83 20.36 34.16 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.751 -0.738 . . . . 5.57 112.427 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -124.89 154.06 41.67 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.569 -0.53 . . . . 5.43 109.569 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 71' ' ' VAL . . . . . 0.589 ' CG2' ' HB3' ' B' ' 91' ' ' SER . 2.7 p -103.96 117.36 49.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-O 121.283 0.564 . . . . 5.65 110.582 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 13.0 tp -108.86 111.05 22.56 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.773 -0.649 . . . . 4.51 110.09 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 73' ' ' SER . . . . . 0.575 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 12.7 m -87.06 112.18 21.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.233 -0.44 . . . . 6.35 111.117 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.2 p -108.82 131.19 60.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.039 -0.528 . . . . 4.34 110.061 179.304 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 25.4 ttt -100.85 115.11 29.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.077 0.465 . . . . 5.42 110.912 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.483 ' HE1' ' HB ' ' B' ' 90' ' ' THR . 50.7 p90 -143.99 178.17 8.04 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.649 -0.705 . . . . 3.54 109.456 179.662 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 77' ' ' ARG . . . . . 0.56 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 12.1 mtm180 -101.09 122.23 43.21 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.998 0.428 . . . . 6.8 110.112 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.432 ' HD1' ' HE2' ' B' ' 76' ' ' PHE . 25.5 t80 -105.78 145.81 30.68 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.604 -0.726 . . . . 5.79 110.119 -179.399 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 79' ' ' ARG . . . . . 0.547 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 30.4 ttt180 -87.22 122.35 30.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.141 -0.481 . . . . 11.08 110.782 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 80' ' ' SER . . . . . 0.505 ' HA ' ' HB ' ' B' ' 33' ' ' VAL . 76.5 p -86.37 -176.81 6.03 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.085 -0.507 . . . . 7.47 109.746 179.028 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 81' ' ' LYS . . . . . 0.417 ' HA ' ' HD2' ' B' ' 81' ' ' LYS . 35.5 tptt -70.63 -13.06 61.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.496 0.665 . . . . 12.24 109.581 178.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -88.61 0.03 56.79 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.595 -0.73 . . . . 9.25 109.626 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 69.76 20.19 6.93 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.393 -0.821 . . . . 8.3 110.832 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 84' ' ' GLU . . . . . 0.435 ' O ' ' HA ' ' B' ' 79' ' ' ARG . 2.8 pt-20 -98.94 151.4 20.93 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.348 -0.387 . . . . 6.78 110.118 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 85' ' ' TRP . . . . . 0.56 ' HB3' ' HB3' ' B' ' 77' ' ' ARG . 44.2 m95 -100.76 103.2 14.43 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.246 -0.434 . . . . 7.89 110.587 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.43 ' H ' ' HG ' ' B' ' 86' ' ' LEU . 0.8 OUTLIER -103.46 151.84 22.35 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.221 -0.445 . . . . 6.97 110.346 179.642 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 87' ' ' TRP . . . . . 0.684 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 89.7 m95 -76.37 114.4 15.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.246 0.546 . . . . 8.55 110.759 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 21.4 tpp -115.21 129.89 56.77 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.216 -0.902 . . . . 4.46 110.792 -178.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 -99.49 85.07 3.08 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.566 -0.901 . . . . 6.87 108.566 178.332 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 90' ' ' THR . . . . . 0.492 HG23 ' HB3' ' B' ' 108' ' ' CYS . 22.7 m -78.82 113.19 16.7 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.759 -0.655 . . . . 6.18 111.86 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 91' ' ' SER . . . . . 0.629 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 20.3 m -93.66 87.7 5.58 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.63 -0.714 . . . . 6.3 109.815 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 92' ' ' SER . . . . . 0.57 ' HA ' ' HA ' ' B' ' 108' ' ' CYS . 14.4 m -72.74 128.75 36.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.903 -0.59 . . . . 6.65 111.419 -178.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -122.71 126.41 47.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.106 -0.497 . . . . 6.45 110.021 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 94' ' ' THR . . . . . 0.686 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.1 OUTLIER -83.3 107.7 16.01 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.709 0.29 . . . . 9.17 110.501 179.406 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 95' ' ' PHE . . . . . 0.46 ' HE1' ' HE2' ' A' ' 24' ' ' PHE . 0.3 OUTLIER -86.27 129.73 34.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.381 -0.372 . . . . 8.33 110.558 -179.466 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -108.48 131.51 54.74 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.011 -0.54 . . . . 10.53 111.028 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 97' ' ' ASN . . . . . 0.43 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 55.9 t30 -71.49 127.9 90.59 Favored Pre-proline 0 C--N 1.32 -0.706 0 N-CA-C 108.866 -0.79 . . . . 8.43 108.866 178.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 98' ' ' PRO . . . . . 0.43 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 57.4 Cg_endo -70.37 45.39 0.52 Allowed 'Trans proline' 0 CA--C 1.534 0.501 0 C-N-CA 123.175 2.583 . . . . 9.16 113.137 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -126.53 -54.22 1.45 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.44 -0.345 . . . . 11.34 110.702 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 48.5 m -137.11 21.43 3.01 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.745 -0.207 . . . . 7.75 111.201 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 25.4 t70 64.8 20.2 12.06 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 121.525 0.679 . . . . 9.08 110.492 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 4.3 pm0 -79.95 142.51 35.01 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.083 -0.508 . . . . 7.71 110.477 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 80.8 mt -76.53 110.86 12.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.751 -0.463 . . . . 8.04 109.751 179.25 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.435 ' H ' ' HG2' ' B' ' 104' ' ' GLU . 5.7 pt-20 -73.04 -45.09 59.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.555 -0.293 . . . . 8.81 110.468 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -168.56 165.61 12.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.939 0.4 . . . . 7.4 110.758 179.016 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 32.7 mt -101.36 113.52 37.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.883 -0.599 . . . . 6.78 109.667 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.529 HG12 ' HG2' ' B' ' 15' ' ' ARG . 64.2 mt -88.72 100.33 10.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.917 -0.583 . . . . 6.31 110.005 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 108' ' ' CYS . . . . . 0.57 ' HA ' ' HA ' ' B' ' 92' ' ' SER . 54.0 m -88.38 106.87 18.53 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.106 0.479 . . . . 5.31 111.204 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 109' ' ' THR . . . . . 0.629 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 0.4 OUTLIER -81.39 87.03 6.19 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.273 -0.64 . . . . 5.48 109.273 178.576 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 110' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -69.61 141.47 53.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.692 -0.686 . . . . 6.9 110.6 -178.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 2.6 m -149.47 113.53 5.16 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.107 -0.331 . . . . 8.61 110.107 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 112' ' ' ASN . . . . . 0.738 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 17.7 t-20 -70.08 133.38 47.11 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.195 0.521 . . . . 11.84 110.987 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 113' ' ' VAL . . . . . 0.476 HG12 ' HG3' ' B' ' 114' ' ' LYS . 66.2 t -113.6 -51.25 5.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.557 -0.747 . . . . 11.77 109.359 179.138 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 114' ' ' LYS . . . . . 0.684 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 61.0 mtpt . . . . . 0 C--O 1.246 0.871 0 CA-C-O 118.369 -0.825 . . . . 12.68 109.609 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 . . . . . 0 N--CA 1.451 -0.417 0 N-CA-C 109.836 -0.431 . . . . 15.08 109.836 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.8 154.49 58.83 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.598 2.198 . . . . 13.43 112.164 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.846 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.7 OUTLIER -79.92 56.09 2.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.493 0.663 . . . . 11.09 110.516 179.593 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.513 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 15.6 tt0 -157.12 117.78 3.58 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.058 -0.974 . . . . 10.59 108.939 -178.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.868 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 35.7 p90 -140.77 162.14 36.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.365 0.602 . . . . 8.93 112.191 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.453 HG23 HG23 ' A' ' 107' ' ' ILE . 42.8 mm -93.99 124.93 46.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.467 -0.788 . . . . 8.66 110.802 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.586 ' HB3' ' HE1' ' A' ' 22' ' ' PHE . 2.4 m -115.14 105.77 13.31 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.27 -0.423 . . . . 6.11 110.934 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -89.97 112.58 24.03 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.278 -0.638 . . . . 9.09 109.278 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.2 p80 -139.22 159.9 41.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.474 0.178 . . . . 9.79 110.991 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -77.98 174.9 10.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.443 -0.344 . . . . 12.69 110.226 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 14.9 pt -57.32 -27.92 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 N-CA-C 113.236 0.828 . . . . 13.58 113.236 -178.555 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -80.44 -17.91 50.33 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.107 0.48 . . . . 13.85 111.453 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 110.11 0.1 29.94 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.506 -0.854 . . . . 9.38 112.793 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ILE . . . . . 0.482 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 30.9 mm -72.73 118.42 17.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.719 -0.474 . . . . 10.74 109.719 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.586 ' HE1' ' HB3' ' A' ' 14' ' ' SER . 90.1 m-85 -72.07 124.91 25.96 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.059 0.457 . . . . 9.73 111.924 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -97.39 -29.2 13.64 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.365 -0.834 . . . . 7.74 110.078 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -158.27 125.54 5.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.714 -0.676 . . . . 6.92 110.01 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.482 HG21 ' HB2' ' A' ' 40' ' ' LEU . 9.5 t -118.96 134.82 61.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.407 -0.36 . . . . 6.02 111.006 -179.376 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.868 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 9.7 t70 -66.26 139.41 58.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.011 -0.54 . . . . 7.31 109.771 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -62.77 -14.23 42.51 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.332 0.493 . . . . 11.67 112.332 -179.137 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.429 ' HB2' ' HB3' ' A' ' 12' ' ' PHE . 79.7 mtm180 -69.04 -10.97 60.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.675 0.274 . . . . 11.91 111.282 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 27.8 p -60.6 -31.98 71.12 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.765 0.317 . . . . 12.99 110.515 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.427 ' O ' ' HA2' ' A' ' 34' ' ' GLY . 42.5 t -62.04 -35.3 67.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.77 -0.65 . . . . 16.15 111.296 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -91.25 -8.1 49.35 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.825 0.345 . . . . 15.07 111.69 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.694 ' HA ' HG22 ' A' ' 10' ' ' THR . 24.7 m -97.13 -55.23 2.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.856 0.36 . . . . 14.9 111.322 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.419 HG12 HD21 ' A' ' 86' ' ' LEU . 2.9 m -117.18 -13.61 10.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.405 -0.361 . . . . 13.84 111.741 -179.452 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.427 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 92.11 -15.15 62.67 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.603 -0.808 . . . . 13.85 112.524 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -75.01 139.01 42.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.564 0.221 . . . . 18.28 110.662 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.536 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 11.5 mm100 -80.59 149.8 68.8 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.394 -0.595 . . . . 15.48 109.394 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.592 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 51.2 Cg_exo -54.8 -37.41 92.27 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.411 2.074 . . . . 11.63 112.388 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.494 ' HA ' HD12 ' A' ' 41' ' ' LEU . 15.5 mp0 -69.77 -19.07 63.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.125 -0.489 . . . . 13.31 111.347 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.536 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 47.1 mt-10 -82.11 -14.33 55.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.971 0.415 . . . . 17.34 110.37 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.482 ' HB2' HG21 ' A' ' 25' ' ' VAL . 3.2 mm? -101.07 -27.31 13.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.866 -0.606 . . . . 13.25 110.301 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 95.1 mt -60.64 125.54 24.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.947 -0.569 . . . . 12.99 110.673 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 81.54 2.71 90.62 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.872 -0.68 . . . . 13.39 112.366 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.725 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 9.1 mmpt? -111.69 160.49 17.22 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.776 0.322 . . . . 16.87 110.647 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.68 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 16.0 m120 -96.48 135.58 38.16 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.041 -0.527 . . . . 12.5 109.698 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.555 HG13 ' HE1' ' A' ' 78' ' ' PHE . 10.6 tt -59.53 -26.09 33.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.18 0.514 . . . . 11.72 110.947 179.176 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.521 HG12 ' HB3' ' A' ' 44' ' ' ASN . 9.9 p -69.93 -22.18 24.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 115.716 -0.675 . . . . 12.89 111.424 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.68 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.5 mt-10 -70.05 -36.06 74.72 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.303 0.573 . . . . 16.53 110.731 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -101.69 34.74 2.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.769 -0.65 . . . . 15.34 110.443 -179.28 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 36.0 t -120.9 150.25 41.36 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.623 -0.717 . . . . 11.97 110.296 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' HIS . . . . . 0.413 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 7.9 t-160 -58.64 126.23 79.16 Favored Pre-proline 0 C--N 1.329 -0.312 0 N-CA-C 109.147 -0.686 . . . . 14.67 109.147 178.616 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -44.51 -48.97 9.61 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 123.348 2.699 . . . . 15.15 114.17 -178.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -73.75 -4.5 34.98 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.36 0.504 . . . . 16.47 112.36 -179.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.429 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 9.3 m-20 -115.37 -2.13 12.7 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.947 0.403 . . . . 13.16 111.133 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -63.11 -41.0 99.25 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.92 -0.582 . . . . 15.83 111.156 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.1 tp60 -64.61 -43.33 94.09 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.732 -0.469 . . . . 13.94 109.732 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.8 tp -59.73 -39.34 84.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.756 -0.656 . . . . 12.11 110.139 178.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.469 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.4 OUTLIER -62.91 -51.31 67.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.842 -0.617 . . . . 9.71 110.402 179.421 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.425 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 62.0 ttt180 -63.25 -43.13 98.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.074 -0.512 . . . . 11.06 110.756 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.461 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 33.6 t70 -59.02 -47.98 83.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.273 -0.421 . . . . 9.71 110.475 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.6 m -62.63 -34.96 78.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.967 -0.56 . . . . 9.52 110.524 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.606 ' O ' HG12 ' A' ' 64' ' ' VAL . 3.5 m-30 -63.96 -42.18 97.35 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.872 -0.418 . . . . 11.4 109.872 178.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 58' ' ' ARG . 82.4 mm-40 -67.98 -32.73 73.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.305 -0.407 . . . . 10.04 110.12 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 59' ' ' ASP . 39.2 mt-30 -70.73 -38.52 73.58 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.095 -0.502 . . . . 10.6 111.035 179.647 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.606 HG12 ' O ' ' A' ' 61' ' ' PHE . 2.7 p -67.42 -25.84 34.38 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 CA-C-O 120.857 0.36 . . . . 10.62 110.519 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' ' 61' ' ' PHE . 89.7 t -74.94 -21.81 16.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 N-CA-C 108.89 -0.782 . . . . 12.41 108.89 178.172 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.7 mtpt -86.07 -32.62 21.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.393 -0.821 . . . . 16.25 109.489 178.567 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.833 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 82.0 mt -69.06 -54.87 12.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.586 -0.733 . . . . 12.66 110.538 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 95.1 mttt 59.67 97.59 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.977 0.798 . . . . 14.83 112.325 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.28 -12.38 68.11 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.647 -0.787 . . . . 9.8 112.235 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.833 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 6.7 tp-100 -99.2 137.22 38.02 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.322 -0.621 . . . . 9.59 109.322 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.473 ' HB ' ' HZ ' ' B' ' 24' ' ' PHE . 3.9 p -88.88 121.93 39.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.3 0.572 . . . . 8.1 110.792 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 41.0 tp -109.45 115.49 30.05 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.699 -0.682 . . . . 7.8 109.734 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.3 m -92.46 104.17 16.52 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.113 -0.494 . . . . 7.59 111.031 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.445 HG13 ' HB ' ' A' ' 90' ' ' THR . 2.4 p -96.98 125.29 50.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.017 -0.538 . . . . 7.84 109.803 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 18.5 ttt -100.98 115.43 30.46 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.995 0.426 . . . . 9.35 111.025 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.429 ' HB2' ' HB3' ' A' ' 53' ' ' ASP . 40.6 p90 -146.28 -172.69 4.0 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.478 -0.783 . . . . 9.66 109.116 179.367 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.66 ' HB3' ' HB3' ' A' ' 85' ' ' TRP . 55.9 mtm180 -108.97 118.27 36.36 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.164 0.507 . . . . 13.1 110.833 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.555 ' HE1' HG13 ' A' ' 45' ' ' ILE . 18.2 t80 -96.71 149.63 21.59 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.4 -0.818 . . . . 9.28 110.407 -179.18 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.614 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 17.1 ttt180 -87.0 121.56 29.64 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.163 -0.471 . . . . 10.87 111.133 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.443 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 60.4 p -88.25 178.63 6.55 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.156 -0.474 . . . . 10.77 110.201 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -70.62 -13.53 62.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.272 0.558 . . . . 12.66 109.934 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -89.97 2.56 54.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.532 -0.758 . . . . 14.42 109.624 179.34 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 67.34 31.98 6.16 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.415 -0.811 . . . . 12.69 111.046 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.53 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 4.1 pt-20 -108.09 171.47 7.39 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.326 -0.62 . . . . 10.85 109.326 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' TRP . . . . . 0.66 ' HB3' ' HB3' ' A' ' 77' ' ' ARG . 23.7 m95 -120.41 98.57 6.11 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.079 -0.341 . . . . 11.2 110.079 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' A' ' 77' ' ' ARG . 1.1 pp -96.8 151.93 19.17 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.334 -0.393 . . . . 11.12 110.886 -179.435 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.533 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 95.5 m95 -73.93 116.54 14.67 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.257 0.551 . . . . 10.28 110.66 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 36.2 tpp -116.54 131.76 56.86 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.397 -0.82 . . . . 9.32 110.79 -179.21 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.412 ' HB3' ' HB ' ' A' ' 111' ' ' THR . 5.2 ttp180 -100.87 70.14 1.37 Allowed 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.326 -0.99 . . . . 10.66 108.326 178.331 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.445 ' HB ' HG13 ' A' ' 74' ' ' VAL . 41.7 m -60.78 107.34 0.68 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.58 -0.736 . . . . 9.37 112.27 -178.328 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' SER . . . . . 0.493 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 0.7 OUTLIER -86.52 88.92 7.74 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.11 -0.95 . . . . 8.27 109.719 179.407 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 18.7 m -77.92 126.43 30.83 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.135 -0.484 . . . . 8.65 111.369 -179.022 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -131.12 117.23 18.79 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.864 -0.607 . . . . 11.56 109.887 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.93 118.73 16.23 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.298 -0.41 . . . . 10.16 110.729 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -91.86 119.8 31.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.018 0.437 . . . . 12.25 110.619 -179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.493 ' HG2' HG12 ' A' ' 103' ' ' ILE . 34.0 mt-30 -124.15 167.51 14.16 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.75 -0.659 . . . . 14.24 110.003 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.441 ' HB2' ' HD2' ' A' ' 99' ' ' TYR . 64.1 m-80 -115.89 172.87 3.36 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 109.381 -0.6 . . . . 13.83 109.381 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.418 ' CD ' ' HB3' ' A' ' 97' ' ' ASN . 6.8 Cg_exo -75.69 28.87 0.38 Allowed 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.522 2.148 . . . . 15.34 112.308 178.929 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' TYR . . . . . 0.441 ' HD2' ' HB2' ' A' ' 97' ' ' ASN . 62.4 m-85 -92.87 -160.6 0.76 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.325 -0.398 . . . . 16.89 110.818 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.2 m -83.26 65.19 8.15 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.613 0.598 . . . . 14.89 112.613 -178.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 41.0 t0 51.01 76.18 0.17 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.646 -0.707 . . . . 14.77 112.45 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.31 165.57 20.29 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.844 -0.617 . . . . 12.95 109.884 179.138 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.493 HG12 ' HG2' ' A' ' 96' ' ' GLN . 80.1 mt -136.86 120.83 23.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 110.218 -0.289 . . . . 11.11 110.218 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.406 ' H ' ' HG2' ' A' ' 104' ' ' GLU . 5.1 pt-20 -81.16 -44.55 17.71 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.614 -0.434 . . . . 11.65 110.469 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -165.46 178.18 6.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.481 -0.327 . . . . 10.3 110.52 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 40.8 mt -115.57 122.95 70.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.078 -0.51 . . . . 10.29 110.224 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.682 HG21 HH22 ' B' ' 15' ' ' ARG . 61.8 mt -93.21 114.84 30.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.13 -0.486 . . . . 8.99 109.863 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 79.5 m -108.77 119.47 39.62 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.119 0.485 . . . . 9.83 111.423 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.493 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 2.6 m -88.16 101.01 13.4 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.643 -0.873 . . . . 10.84 108.643 178.334 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ASN . . . . . 0.513 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 42.6 m-20 -79.23 104.32 9.77 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.232 -0.44 . . . . 11.26 111.547 -178.375 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' THR . . . . . 0.412 ' HB ' ' HB3' ' A' ' 89' ' ' ARG . 5.6 m -104.18 118.83 37.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.623 -0.717 . . . . 11.22 110.515 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ASN . . . . . 0.846 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 3.5 t-20 -80.82 117.9 21.87 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.015 0.435 . . . . 12.78 110.299 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 18.9 t -97.77 -54.62 6.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.864 -0.607 . . . . 14.64 109.776 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 48.9 mtpt . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.224 -0.893 . . . . 16.02 109.52 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 71.5 m . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 110.108 -0.33 . . . . 7.49 110.108 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 8' ' ' GLN . . . . . 0.938 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 93.0 mm-40 -112.85 150.42 42.79 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 116.529 -0.305 . . . . 7.12 110.828 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.2 174.32 12.67 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 123.015 2.476 . . . . 6.18 113.131 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 10' ' ' THR . . . . . 0.508 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.0 OUTLIER -83.56 58.51 4.61 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 116.001 -0.545 . . . . 5.81 111.536 -179.86 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.589 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 7.7 pt-20 -166.42 136.42 3.24 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.173 -0.677 . . . . 5.85 109.173 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 12' ' ' PHE . . . . . 0.41 ' HB3' ' HB2' ' B' ' 28' ' ' ARG . 39.6 p90 -146.12 156.61 43.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.331 0.586 . . . . 6.08 112.005 -179.047 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.503 HG22 ' HG3' ' B' ' 15' ' ' ARG . 28.0 mm -86.08 119.13 33.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.359 -0.837 . . . . 5.57 110.264 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.797 ' HB3' ' HE2' ' B' ' 22' ' ' PHE . 1.2 m -107.13 92.12 3.95 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.963 -0.562 . . . . 5.3 110.507 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 15' ' ' ARG . . . . . 0.682 HH22 HG21 ' A' ' 107' ' ' ILE . 8.5 mtp180 -85.3 102.06 13.06 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.308 -0.627 . . . . 8.97 109.308 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 16' ' ' HIS . . . . . 0.419 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 29.9 p80 -131.43 164.07 26.54 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.236 -0.438 . . . . 8.31 110.872 -179.005 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -78.2 179.18 7.05 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.318 -0.401 . . . . 10.83 110.621 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 27.3 pt -56.88 -33.32 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 113.252 0.834 . . . . 8.89 113.252 -178.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -76.13 -21.94 56.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.088 0.471 . . . . 11.92 111.382 -179.025 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 114.05 -4.19 23.97 Favored Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 120.665 -0.779 . . . . 8.57 112.327 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 21' ' ' ILE . . . . . 0.43 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 38.7 mm -67.15 114.26 3.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.939 -0.393 . . . . 10.87 109.939 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 22' ' ' PHE . . . . . 0.797 ' HE2' ' HB3' ' B' ' 14' ' ' SER . 97.3 m-85 -68.48 126.32 29.27 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.168 -0.469 . . . . 8.23 111.242 -179.505 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 3.9 m -100.01 -37.88 8.81 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.61 -0.723 . . . . 7.91 110.171 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 24' ' ' PHE . . . . . 0.486 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 30.1 t80 -147.77 123.41 10.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.675 -0.693 . . . . 7.89 109.496 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 25' ' ' VAL . . . . . 0.536 HG21 ' HB2' ' B' ' 40' ' ' LEU . 14.5 t -120.46 138.87 49.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 120.884 0.374 . . . . 6.1 111.074 -179.005 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 26' ' ' ASP . . . . . 0.403 ' CG ' ' HE ' ' B' ' 28' ' ' ARG . 10.7 t70 -71.15 153.55 42.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.852 -0.613 . . . . 7.15 109.971 179.191 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 34.9 m170 -70.16 -10.82 60.0 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.806 0.299 . . . . 8.97 111.806 -178.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 28' ' ' ARG . . . . . 0.938 ' HG2' ' HB3' ' B' ' 8' ' ' GLN . 72.7 mtm180 -68.08 -11.45 59.07 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 111.995 0.368 . . . . 9.76 111.995 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 20.2 p -58.32 -38.76 77.77 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 111.861 0.319 . . . . 11.56 111.861 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 4.1 t -66.39 -31.96 55.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.338 -0.392 . . . . 13.64 111.072 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.63 -10.82 56.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.904 0.383 . . . . 12.9 111.458 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 32' ' ' THR . . . . . 0.455 ' HA ' HG22 ' B' ' 10' ' ' THR . 14.8 m -99.74 -59.83 1.64 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.068 -0.515 . . . . 12.13 111.978 -179.252 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 33' ' ' VAL . . . . . 0.726 HG12 HD21 ' B' ' 86' ' ' LEU . 3.3 m -116.57 -5.48 11.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 111.824 0.305 . . . . 13.87 111.824 -179.0 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.22 0.94 89.61 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.651 -0.785 . . . . 13.79 112.285 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 35' ' ' TYR . . . . . 0.45 ' HB2' HG23 ' B' ' 33' ' ' VAL . 2.4 m-85 -80.1 137.0 36.66 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.644 0.259 . . . . 15.38 111.054 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 36' ' ' GLN . . . . . 0.57 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 75.8 mm-40 -79.4 150.01 73.03 Favored Pre-proline 0 C--N 1.322 -0.63 0 N-CA-C 108.667 -0.864 . . . . 13.78 108.667 178.256 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 37' ' ' PRO . . . . . 0.528 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 51.6 Cg_exo -53.18 -38.5 81.26 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.613 2.208 . . . . 14.71 112.303 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -67.79 -22.2 65.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.965 -0.561 . . . . 17.54 111.408 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 39' ' ' GLU . . . . . 0.57 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 36.4 mt-10 -73.82 -23.12 59.62 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.655 0.264 . . . . 14.24 110.951 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.536 ' HB2' HG21 ' B' ' 25' ' ' VAL . 1.7 mm? -93.17 -34.92 13.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.895 0.379 . . . . 14.03 110.625 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 41' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 81.7 mt -58.31 119.07 6.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 13.62 111.259 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.33 5.01 76.55 Favored Glycine 0 N--CA 1.454 -0.163 0 C-N-CA 121.002 -0.618 . . . . 11.62 112.636 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.457 ' HA ' ' NZ ' ' B' ' 43' ' ' LYS . 0.5 OUTLIER -119.04 159.53 23.71 Favored 'General case' 0 C--N 1.321 -0.664 0 O-C-N 122.586 -0.361 . . . . 13.82 110.353 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 44' ' ' ASN . . . . . 0.672 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 12.5 m120 -95.46 140.15 30.73 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.35 -0.611 . . . . 10.16 109.35 178.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 20.8 tt -61.28 -24.63 33.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.305 0.574 . . . . 9.62 110.542 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 46' ' ' VAL . . . . . 0.41 HG12 ' HB3' ' B' ' 44' ' ' ASN . 9.0 p -71.84 -22.68 21.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.774 -0.648 . . . . 11.5 111.183 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 47' ' ' GLU . . . . . 0.672 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 40.5 mt-10 -67.07 -34.6 78.0 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.164 0.507 . . . . 11.89 110.481 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -104.08 24.67 11.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.729 -0.669 . . . . 13.6 110.433 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 49.0 t -109.19 148.78 30.38 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.832 -0.622 . . . . 10.81 110.41 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 8.1 t-160 -64.9 126.72 91.69 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.713 -0.676 . . . . 11.49 109.236 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -43.24 -48.8 7.81 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 123.534 2.823 . . . . 11.35 113.779 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -70.53 -7.91 47.34 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.135 0.42 . . . . 9.28 112.135 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 53' ' ' ASP . . . . . 0.637 ' HB3' ' HB2' ' B' ' 76' ' ' PHE . 16.5 m-20 -117.57 -1.17 11.71 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.951 0.405 . . . . 7.52 110.706 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -65.14 -49.22 70.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.969 -0.559 . . . . 6.57 111.659 -178.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -64.96 -34.86 79.43 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.504 -0.554 . . . . 6.58 109.504 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.3 tp -58.09 -42.92 86.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.961 -0.563 . . . . 4.6 109.777 178.386 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 57' ' ' LEU . . . . . 0.454 HD23 ' HA ' ' B' ' 57' ' ' LEU . 0.9 OUTLIER -69.16 -48.95 60.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.94 -0.573 . . . . 6.4 110.265 179.007 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 58' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' B' ' 58' ' ' ARG . 28.5 ttt180 -57.45 -46.32 83.75 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.875 -0.602 . . . . 8.18 111.244 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 59' ' ' ASP . . . . . 0.4 ' O ' ' HG3' ' B' ' 63' ' ' GLN . 12.7 t70 -61.0 -41.21 96.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.227 -0.442 . . . . 6.07 110.744 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 44.6 m -64.15 -35.54 81.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.479 . . . . 5.59 110.486 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 61' ' ' PHE . . . . . 0.508 ' O ' HG12 ' B' ' 64' ' ' VAL . 9.7 m-85 -64.18 -40.85 96.97 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.475 -0.565 . . . . 7.73 109.475 178.733 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 78.4 mm-40 -63.15 -38.83 92.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.96 -0.564 . . . . 6.89 109.969 178.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 63' ' ' GLN . . . . . 0.513 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 68.6 mt-30 -67.14 -47.62 70.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.688 -0.687 . . . . 9.4 111.132 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 64' ' ' VAL . . . . . 0.508 HG12 ' O ' ' B' ' 61' ' ' PHE . 4.1 p -62.24 -30.99 50.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-N 116.387 -0.37 . . . . 7.57 111.864 -178.595 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 65' ' ' VAL . . . . . 0.478 HG23 ' O ' ' B' ' 61' ' ' PHE . 70.9 t -68.75 -37.65 77.78 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 109.516 -0.55 . . . . 7.43 109.516 178.829 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -71.57 -32.72 68.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.786 -0.643 . . . . 10.21 110.165 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 67' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' B' ' 63' ' ' GLN . 94.0 mt -67.33 -54.13 23.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.854 -0.612 . . . . 7.2 110.365 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 23.5 mttt 63.26 113.37 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.439 -0.8 . . . . 7.58 112.008 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 77.26 19.81 76.23 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.798 -0.715 . . . . 5.57 112.17 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -126.01 153.5 44.3 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.937 -0.394 . . . . 5.43 109.937 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 71' ' ' VAL . . . . . 0.519 ' CG2' ' HB3' ' B' ' 91' ' ' SER . 3.3 p -110.96 116.37 52.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-O 121.299 0.571 . . . . 5.65 110.518 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 18.7 tp -107.95 116.56 32.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.701 -0.681 . . . . 4.51 110.306 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 73' ' ' SER . . . . . 0.547 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 7.6 m -90.36 115.7 27.75 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.175 -0.466 . . . . 6.35 110.995 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 p -113.83 126.96 71.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 116.096 -0.502 . . . . 4.34 110.107 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 24.7 ttt -94.83 113.79 25.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.167 0.508 . . . . 5.42 110.563 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.637 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 48.0 p90 -137.9 -174.58 3.82 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.63 -0.714 . . . . 3.54 109.397 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 77' ' ' ARG . . . . . . . . . . . . . 9.3 mtm180 -108.3 115.19 29.66 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.99 0.424 . . . . 6.8 110.11 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.552 ' HD2' HG11 ' B' ' 33' ' ' VAL . 28.0 t80 -100.52 148.46 24.77 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.656 -0.702 . . . . 5.79 110.282 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 79' ' ' ARG . . . . . 0.535 ' HA ' ' O ' ' B' ' 84' ' ' GLU . 20.2 ttp180 -85.77 133.47 33.99 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.142 -0.481 . . . . 11.08 110.725 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 80' ' ' SER . . . . . 0.476 ' HA ' ' HB ' ' B' ' 33' ' ' VAL . 96.6 p -93.14 179.48 5.41 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.522 -0.547 . . . . 7.47 109.522 178.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 47.3 tptt -67.89 -14.76 63.22 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.607 0.718 . . . . 12.24 109.53 178.377 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 40.0 m-20 -89.02 2.52 53.89 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.151 -0.931 . . . . 9.25 109.685 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 66.49 25.08 10.22 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 115.305 -0.862 . . . . 8.3 111.522 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 84' ' ' GLU . . . . . 0.535 ' O ' ' HA ' ' B' ' 79' ' ' ARG . 1.9 pt-20 -104.29 167.15 9.94 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.228 -0.656 . . . . 6.78 109.228 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 85' ' ' TRP . . . . . 0.518 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 49.3 m95 -109.04 118.82 37.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.049 0.452 . . . . 7.89 110.69 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 86' ' ' LEU . . . . . 0.726 HD21 HG12 ' B' ' 33' ' ' VAL . 2.1 pp -116.02 150.38 37.33 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.004 -0.544 . . . . 6.97 109.986 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 87' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -72.73 122.19 21.09 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.871 -0.418 . . . . 8.55 109.871 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 15.0 tpp -128.35 126.6 41.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.135 -0.484 . . . . 4.46 110.96 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 30.3 ttp180 -100.19 87.58 3.49 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.292 -1.003 . . . . 6.87 108.292 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 90' ' ' THR . . . . . 0.457 HG23 ' HB3' ' B' ' 108' ' ' CYS . 28.0 m -80.66 112.87 18.42 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.672 -0.694 . . . . 6.18 112.309 -178.305 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 91' ' ' SER . . . . . 0.67 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 44.5 m -88.76 90.67 8.51 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.584 -0.734 . . . . 6.3 109.179 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 92' ' ' SER . . . . . 0.541 ' HA ' ' HA ' ' B' ' 108' ' ' CYS . 15.6 m -78.77 122.37 25.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.235 -0.438 . . . . 6.65 111.502 -178.546 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -118.17 121.37 40.33 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.284 -0.417 . . . . 6.45 110.562 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 94' ' ' THR . . . . . 0.437 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.6 OUTLIER -86.19 100.72 12.43 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.426 -0.352 . . . . 9.17 110.189 179.051 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -76.71 126.28 30.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.988 0.423 . . . . 8.33 111.084 -179.403 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -94.84 116.33 28.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.867 -0.606 . . . . 10.53 109.731 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 97' ' ' ASN . . . . . 0.402 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 51.5 t30 -65.46 126.75 92.11 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 109.544 -0.539 . . . . 8.43 109.544 179.498 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 98' ' ' PRO . . . . . 0.402 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 58.2 Cg_endo -71.29 42.72 0.46 Allowed 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 123.076 2.518 . . . . 9.16 113.693 -178.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -118.56 -61.2 1.69 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.407 -0.59 . . . . 11.34 109.407 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -135.14 22.47 3.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.638 -0.71 . . . . 7.75 109.868 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 4.3 t70 63.42 24.59 14.21 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.549 -0.75 . . . . 9.08 110.727 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -84.93 143.03 29.25 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.995 0.426 . . . . 7.71 110.462 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 67.1 mt -79.72 109.43 14.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.295 -0.412 . . . . 8.04 109.896 179.469 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -71.6 -41.93 68.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.422 -0.353 . . . . 8.81 110.647 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -169.89 168.63 8.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.296 -0.411 . . . . 7.4 109.911 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 22.1 mt -103.21 118.89 50.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.106 -0.497 . . . . 6.78 110.036 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 46.3 mt -88.62 93.19 4.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.74 -0.664 . . . . 6.31 109.912 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 108' ' ' CYS . . . . . 0.541 ' HA ' ' HA ' ' B' ' 92' ' ' SER . 67.1 m -87.75 116.79 26.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.183 -0.462 . . . . 5.31 111.295 -179.658 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 109' ' ' THR . . . . . 0.67 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 1.2 m -88.69 83.38 6.73 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.149 -0.686 . . . . 5.48 109.149 178.767 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 110' ' ' ASN . . . . . 0.525 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 6.1 m-20 -67.24 103.08 1.16 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.707 -0.679 . . . . 6.9 111.14 -178.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 1.1 m -110.85 114.39 27.7 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.415 -0.357 . . . . 8.61 110.332 179.365 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 112' ' ' ASN . . . . . 0.508 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 3.0 t30 -68.65 135.32 51.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.02 0.438 . . . . 11.84 110.772 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 9.4 t -104.29 -59.06 3.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.868 -0.606 . . . . 11.77 109.627 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 24.3 mtpt . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.207 -0.902 . . . . 12.68 109.945 -179.858 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.5 m . . . . . 0 N--CA 1.477 0.91 0 CA-C-O 120.75 0.309 . . . . 15.6 110.188 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.554 ' HA ' HG11 ' B' ' 71' ' ' VAL . 16.5 mt-30 -83.63 118.22 70.84 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.388 -0.369 . . . . 15.08 110.728 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -72.87 159.8 47.44 Favored 'Trans proline' 0 C--O 1.234 0.292 0 C-N-CA 122.859 2.373 . . . . 13.43 112.013 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.511 HG22 HG23 ' A' ' 32' ' ' THR . 0.1 OUTLIER -83.14 52.04 2.1 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.333 0.587 . . . . 11.09 111.106 179.92 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.667 ' HB2' HG23 ' A' ' 111' ' ' THR . 37.6 tt0 -147.09 136.93 23.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.446 -0.797 . . . . 10.59 108.964 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.84 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 42.5 p90 -151.75 154.16 35.72 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.071 0.463 . . . . 8.93 111.489 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.432 HD13 ' HA ' ' A' ' 13' ' ' ILE . 21.1 mm -88.64 127.31 41.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.061 -0.518 . . . . 8.66 110.842 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.901 ' HB3' ' HE2' ' A' ' 22' ' ' PHE . 1.4 m -110.23 97.39 6.88 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.831 -0.622 . . . . 6.11 110.791 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 11.2 mtt180 -86.24 110.43 19.61 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.545 -0.539 . . . . 9.09 109.545 179.342 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 33.3 p80 -147.03 156.2 42.83 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.629 -0.259 . . . . 9.79 110.558 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -76.62 -175.68 3.46 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.628 0.252 . . . . 12.69 110.926 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 26.9 pt -62.31 -25.44 37.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 N-CA-C 112.873 0.694 . . . . 13.58 112.873 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -76.5 -30.53 57.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.214 0.53 . . . . 13.85 110.669 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 118.02 -6.38 15.4 Favored Glycine 0 N--CA 1.444 -0.814 0 N-CA-C 111.225 -0.75 . . . . 9.38 111.225 -179.371 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.444 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 34.6 mm -68.69 117.84 11.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 O-C-N 123.973 0.455 . . . . 10.74 109.791 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.901 ' HE2' ' HB3' ' A' ' 14' ' ' SER . 87.7 m-85 -73.2 132.92 43.78 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.083 0.468 . . . . 9.73 112.081 -178.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.02 -27.37 12.17 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.3 -0.864 . . . . 7.74 110.278 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.434 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 31.2 t80 -154.33 121.63 5.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.701 -0.681 . . . . 6.92 109.516 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.611 ' HB ' ' HB3' ' A' ' 37' ' ' PRO . 4.8 t -110.39 146.36 15.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.033 0.444 . . . . 6.02 111.236 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.84 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 6.0 t70 -68.5 170.89 8.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.546 -0.752 . . . . 7.31 110.459 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -94.27 -21.43 19.02 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.11 0.481 . . . . 11.67 110.077 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 77.0 mtm180 -78.92 0.1 28.73 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.866 -0.606 . . . . 11.91 111.89 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 28.2 p -64.96 -33.51 76.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.972 0.415 . . . . 12.99 110.641 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.502 ' O ' ' HA2' ' A' ' 34' ' ' GLY . 2.9 t -69.59 -27.08 32.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.933 -0.576 . . . . 16.15 110.726 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.92 -24.38 26.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.105 0.479 . . . . 15.07 110.278 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.511 HG23 HG22 ' A' ' 10' ' ' THR . 25.2 m -85.01 -61.92 1.66 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.753 -0.658 . . . . 14.9 111.699 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.612 HG23 ' H ' ' A' ' 35' ' ' TYR . 15.6 m -111.35 -15.22 10.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 111.941 0.349 . . . . 13.84 111.941 -179.245 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.502 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 89.39 0.11 80.19 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.423 -0.894 . . . . 13.85 112.325 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.612 ' H ' HG23 ' A' ' 33' ' ' VAL . 0.7 OUTLIER -83.46 135.04 34.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.653 0.263 . . . . 18.28 110.458 179.882 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.669 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 79.0 mm-40 -75.41 146.71 81.49 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 116.054 -0.521 . . . . 15.48 110.059 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.611 ' HB3' ' HB ' ' A' ' 25' ' ' VAL . 41.6 Cg_exo -57.12 -35.35 98.89 Favored 'Trans proline' 0 CA--C 1.527 0.166 0 C-N-CA 122.588 2.192 . . . . 11.63 112.185 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.436 ' HA ' HD12 ' A' ' 41' ' ' LEU . 22.4 mp0 -69.25 -15.93 63.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.96 -0.564 . . . . 13.31 111.493 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.669 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 34.8 mt-10 -81.09 -32.48 33.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.786 0.327 . . . . 17.34 111.013 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.565 ' HB2' HG21 ' A' ' 25' ' ' VAL . 2.9 mm? -82.1 -24.66 35.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.121 -0.49 . . . . 13.25 110.915 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 89.7 mt -62.69 116.69 5.42 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.136 -0.484 . . . . 12.99 111.402 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.32 -4.26 85.34 Favored Glycine 0 N--CA 1.451 -0.339 0 CA-C-N 115.879 -0.601 . . . . 13.39 112.694 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.466 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 6.1 mmpt? -107.87 161.91 14.49 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.617 0.246 . . . . 16.87 110.457 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.762 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 15.1 m120 -95.66 139.02 32.51 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.544 -0.539 . . . . 12.5 109.544 179.094 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.58 HG13 ' HE1' ' A' ' 78' ' ' PHE . 9.1 tt -61.85 -30.37 48.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.016 0.436 . . . . 11.72 110.589 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.0 p -65.7 -22.03 30.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 116.183 -0.462 . . . . 12.89 111.254 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.762 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 41.1 mt-10 -73.83 -17.73 61.03 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.358 -0.383 . . . . 16.53 111.553 -179.304 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -117.97 24.53 10.96 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.17 0.51 . . . . 15.34 110.198 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 48.9 t -112.08 155.73 23.38 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.665 -0.698 . . . . 11.97 110.305 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.59 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 4.9 t-160 -56.92 122.33 51.93 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.842 -0.617 . . . . 14.67 109.408 178.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 99.2 Cg_exo -45.29 -49.06 10.7 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.456 2.77 . . . . 15.15 114.157 -178.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -75.77 0.93 16.22 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.291 0.478 . . . . 16.47 112.291 -179.136 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.59 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 26.4 m-20 -124.96 7.78 8.03 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.162 0.506 . . . . 13.16 110.159 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -66.35 -44.1 84.17 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.79 -0.641 . . . . 15.83 110.592 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.7 tp60 -62.58 -38.36 89.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.302 -0.408 . . . . 13.94 109.925 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.9 tp -57.48 -40.12 77.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.89 -0.595 . . . . 12.11 110.182 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.417 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.9 OUTLIER -69.59 -49.03 58.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.793 -0.639 . . . . 9.71 110.155 179.348 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.426 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 70.6 ttt180 -58.61 -48.61 80.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.986 -0.552 . . . . 11.06 111.392 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -56.56 -44.98 81.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.039 0.447 . . . . 9.71 110.807 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.3 m -70.28 -31.36 68.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.017 -0.538 . . . . 9.52 110.994 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.56 ' O ' HG12 ' A' ' 64' ' ' VAL . 1.4 m-30 -65.12 -49.99 67.79 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.048 -0.353 . . . . 11.4 110.048 178.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 58' ' ' ARG . 65.9 mm-40 -64.8 -29.9 70.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.337 0.589 . . . . 10.04 109.572 179.252 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -66.27 -48.56 70.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.014 -0.993 . . . . 10.6 110.648 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.56 HG12 ' O ' ' A' ' 61' ' ' PHE . 4.3 p -64.74 -25.1 37.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-O 120.838 0.351 . . . . 10.62 110.87 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.615 ' HA ' HG21 ' A' ' 94' ' ' THR . 93.1 t -70.61 -40.39 77.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 108.954 -0.758 . . . . 12.41 108.954 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -72.97 -29.24 62.91 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.546 -0.752 . . . . 16.25 109.963 178.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.737 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 88.7 mt -70.13 -48.17 58.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.981 -0.554 . . . . 12.66 109.94 178.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 32.8 mttt 59.61 99.47 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.571 -0.741 . . . . 14.83 112.607 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.03 -26.27 13.75 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.674 -0.774 . . . . 9.8 112.886 178.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.737 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 46.4 tp60 -79.11 113.12 16.98 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.744 0.307 . . . . 9.59 110.251 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 3.0 p -66.64 116.6 6.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.804 -0.634 . . . . 8.1 110.805 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 64.8 tp -111.88 108.15 17.42 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.696 -0.684 . . . . 7.8 110.381 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.561 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 1.2 m -87.45 109.33 19.51 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.961 -0.563 . . . . 7.59 110.95 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.8 p -102.34 132.93 47.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.766 -0.457 . . . . 7.84 109.766 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' MET . . . . . 0.479 ' HG2' ' HE3' ' A' ' 87' ' ' TRP . 23.1 ttt -102.41 122.0 43.44 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.904 0.383 . . . . 9.35 111.07 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.518 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 47.8 p90 -148.89 -174.7 4.7 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.204 -0.453 . . . . 9.66 110.075 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.49 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 31.2 mtm180 -110.61 120.65 43.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.12 0.486 . . . . 13.1 110.297 178.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.58 ' HE1' HG13 ' A' ' 45' ' ' ILE . 15.9 t80 -101.0 153.51 19.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.311 -0.859 . . . . 9.28 110.143 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.53 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 42.7 ttt180 -90.01 124.0 34.38 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.13 -0.486 . . . . 10.87 110.636 179.596 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.42 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 59.5 p -85.84 -179.43 6.82 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.22 -0.446 . . . . 10.77 110.469 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -71.16 -14.45 62.28 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.516 0.674 . . . . 12.66 109.476 179.003 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.456 ' O ' ' HB2' ' A' ' 83' ' ' GLN . 87.9 m-20 -88.77 -1.79 58.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.435 -0.802 . . . . 14.42 109.74 179.031 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' A' ' 82' ' ' ASN . 2.9 mp0 72.54 22.62 3.28 Favored 'General case' 0 N--CA 1.465 0.277 0 O-C-N 123.902 0.751 . . . . 12.69 110.748 -179.239 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.482 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.0 pt-20 -97.68 170.41 9.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.823 -0.626 . . . . 10.85 109.515 179.264 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.53 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 51.5 m95 -116.72 110.75 18.85 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.86 0.362 . . . . 11.2 110.529 -179.572 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.49 ' O ' ' HA ' ' A' ' 77' ' ' ARG . 0.5 OUTLIER -108.74 150.17 27.98 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.09 -0.504 . . . . 11.12 110.581 -179.821 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.904 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 72.0 m95 -82.35 117.12 22.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.972 0.415 . . . . 10.28 110.394 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.419 ' SD ' ' HB3' ' A' ' 110' ' ' ASN . 9.2 ttp -126.04 138.59 53.73 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.055 -0.52 . . . . 9.32 110.602 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 33.1 ttp-105 -103.81 107.38 18.23 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.896 -0.779 . . . . 10.66 108.896 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.629 HG23 ' HB3' ' A' ' 108' ' ' CYS . 24.7 m -92.61 105.37 17.54 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.742 -0.663 . . . . 9.37 112.426 -178.401 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.784 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 64.0 m -82.28 87.21 6.57 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.525 -0.917 . . . . 8.27 108.525 177.627 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.493 ' HA ' ' HA ' ' A' ' 108' ' ' CYS . 32.8 m -74.98 125.23 28.46 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.059 -0.519 . . . . 8.65 111.739 -178.625 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -123.41 109.52 13.97 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.593 -0.73 . . . . 11.56 109.58 179.047 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.615 HG21 ' HA ' ' A' ' 65' ' ' VAL . 0.2 OUTLIER -72.11 123.41 22.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.424 -0.353 . . . . 10.16 110.483 179.922 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 95' ' ' PHE . . . . . 0.442 ' O ' ' HA ' ' A' ' 103' ' ' ILE . 23.0 t80 -92.48 113.21 25.43 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.929 0.395 . . . . 12.25 111.09 -179.024 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -92.62 132.21 37.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.855 -0.611 . . . . 14.24 110.487 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -85.29 138.62 36.4 Favored Pre-proline 0 C--N 1.319 -0.751 0 N-CA-C 109.752 -0.462 . . . . 13.83 109.752 178.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -64.2 -11.45 27.84 Favored 'Trans proline' 0 CA--C 1.531 0.362 0 C-N-CA 122.753 2.302 . . . . 15.34 114.053 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -62.98 -74.7 0.09 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.741 0.305 . . . . 16.89 110.998 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.3 m -127.08 24.52 6.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.579 -0.282 . . . . 14.89 110.966 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 28.7 t70 62.64 35.52 14.19 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.445 0.641 . . . . 14.77 110.615 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.1 139.47 30.94 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.406 -0.361 . . . . 12.95 110.382 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.442 ' HA ' ' O ' ' A' ' 95' ' ' PHE . 50.5 mt -83.32 106.97 14.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.209 -0.45 . . . . 11.11 109.967 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -73.2 -38.96 65.93 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.882 -0.327 . . . . 11.65 110.661 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.458 ' HE1' HG12 ' A' ' 107' ' ' ILE . 16.3 p90 -159.8 167.98 26.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.378 -0.374 . . . . 10.3 110.291 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 21.4 mt -110.18 120.63 61.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.969 -0.56 . . . . 10.29 110.138 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.606 HG21 HH22 ' B' ' 15' ' ' ARG . 15.7 mt -88.54 95.92 5.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.098 -0.501 . . . . 8.99 109.657 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.629 ' HB3' HG23 ' A' ' 90' ' ' THR . 96.3 m -91.07 116.32 28.7 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.086 -0.507 . . . . 9.83 111.936 -178.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.784 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 2.8 m -86.97 97.55 10.76 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.798 -0.815 . . . . 10.84 108.798 178.286 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.441 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 8.5 m-20 -86.14 104.82 16.07 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.143 -0.481 . . . . 11.26 111.908 -177.805 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.667 HG23 ' HB2' ' A' ' 11' ' ' GLU . 1.9 m -112.15 120.05 40.48 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.751 -0.462 . . . . 11.22 109.751 178.374 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ASN . . . . . 0.482 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 2.1 t30 -72.13 129.57 38.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.182 0.515 . . . . 12.78 111.072 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 3.5 t -103.45 -46.36 10.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.543 -0.753 . . . . 14.64 110.058 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.904 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 51.8 mtpt . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.44 -0.79 . . . . 16.02 109.74 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 56.1 m . . . . . 0 N--CA 1.479 1.02 0 CA-C-O 120.989 0.423 . . . . 7.49 110.373 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 8' ' ' GLN . . . . . 0.83 ' HG3' ' HA ' ' B' ' 28' ' ' ARG . 1.7 pm0 -108.15 150.6 40.67 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.234 -0.439 . . . . 7.12 109.887 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' B' ' 8' ' ' GLN . 11.3 Cg_exo -72.32 176.23 8.9 Favored 'Trans proline' 0 C--O 1.234 0.287 0 C-N-CA 122.842 2.361 . . . . 6.18 112.23 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 10' ' ' THR . . . . . 0.746 HG22 ' HA ' ' B' ' 32' ' ' THR . 0.1 OUTLIER -82.59 50.5 1.67 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.272 -0.422 . . . . 5.81 111.684 -179.718 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.591 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -148.28 139.71 23.53 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.608 -0.515 . . . . 5.85 109.608 179.709 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 12' ' ' PHE . . . . . 0.738 ' HB3' ' HB2' ' B' ' 28' ' ' ARG . 33.8 p90 -155.28 153.37 30.49 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.018 0.437 . . . . 6.08 111.245 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.568 HG13 HG23 ' B' ' 107' ' ' ILE . 9.1 tt -88.03 113.26 24.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.651 -0.704 . . . . 5.57 110.47 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.443 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.7 OUTLIER -98.1 91.66 5.39 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.963 -0.562 . . . . 5.3 110.633 179.641 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 15' ' ' ARG . . . . . 0.62 ' HD3' ' HD2' ' B' ' 24' ' ' PHE . 8.7 mtp180 -82.56 111.22 18.35 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.884 -0.784 . . . . 8.97 108.884 179.281 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 16' ' ' HIS . . . . . 0.792 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 0.6 OUTLIER -146.51 172.5 13.46 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.367 -0.379 . . . . 8.31 111.425 -178.55 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -82.01 175.53 10.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.204 -0.453 . . . . 10.83 110.98 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 18.2 pt -58.82 -28.49 37.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 N-CA-C 113.039 0.755 . . . . 8.89 113.039 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -79.22 -10.37 59.8 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.882 0.372 . . . . 11.92 111.51 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 101.86 -8.35 55.99 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.452 -0.88 . . . . 8.57 112.987 179.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' ILE . . . . . 0.511 ' O ' ' HB2' ' B' ' 16' ' ' HIS . 24.8 mm -63.86 111.97 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 110.235 -0.283 . . . . 10.87 110.235 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 22' ' ' PHE . . . . . 0.792 ' HA ' ' HB3' ' B' ' 16' ' ' HIS . 97.4 m-85 -63.75 125.13 23.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.125 -0.489 . . . . 8.23 111.705 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 3.1 m -98.87 -44.47 6.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.537 -0.756 . . . . 7.91 110.605 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' PHE . . . . . 0.62 ' HD2' ' HD3' ' B' ' 15' ' ' ARG . 78.5 t80 -147.35 123.0 10.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.878 -0.601 . . . . 7.89 109.983 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 25.7 t -120.72 131.58 72.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.177 -0.465 . . . . 6.1 110.361 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -69.77 158.94 34.49 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.748 -0.464 . . . . 7.15 109.748 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 23.5 m-70 -78.2 51.03 0.96 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.29 -0.414 . . . . 8.97 111.717 -178.359 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' ARG . . . . . 0.83 ' HA ' ' HG3' ' B' ' 8' ' ' GLN . 23.5 mtm180 -125.37 -16.98 5.74 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.816 0.341 . . . . 9.76 110.583 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 22.7 p -61.71 -27.01 68.41 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.167 -0.469 . . . . 11.56 111.656 -179.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 34.0 t -59.75 -39.52 79.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.052 -0.522 . . . . 13.64 111.19 -179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.9 -15.4 39.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.332 -0.395 . . . . 12.9 111.285 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' THR . . . . . 0.746 ' HA ' HG22 ' B' ' 10' ' ' THR . 4.1 m -88.59 -53.27 4.73 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.254 0.464 . . . . 12.13 112.254 -178.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 33' ' ' VAL . . . . . 0.624 HG11 ' HD2' ' B' ' 78' ' ' PHE . 3.5 m -124.93 -13.07 5.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 112.455 0.539 . . . . 13.87 112.455 -178.837 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.1 -21.0 36.56 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.4 -0.905 . . . . 13.79 112.06 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -67.08 128.88 38.02 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.92 -0.4 . . . . 15.38 109.92 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 36' ' ' GLN . . . . . 0.566 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 12.4 mm100 -74.99 149.79 85.46 Favored Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 109.62 -0.511 . . . . 13.78 109.62 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.596 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 61.9 Cg_exo -51.4 -42.27 55.72 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.748 2.298 . . . . 14.71 112.503 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 -62.17 -27.92 69.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.907 -0.588 . . . . 17.54 111.577 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.566 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 30.6 mt-10 -72.84 -33.22 66.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.385 -0.371 . . . . 14.24 110.449 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.414 ' HB3' ' CG ' ' B' ' 22' ' ' PHE . 1.1 mm? -80.83 -30.89 35.69 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.104 -0.498 . . . . 14.03 111.106 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 79.6 mt -60.03 119.19 7.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 13.62 110.937 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.05 5.61 73.03 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.976 -0.63 . . . . 11.62 112.448 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.492 ' O ' ' HA ' ' B' ' 21' ' ' ILE . 1.7 mmpt? -116.64 154.29 30.79 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.63 0.252 . . . . 13.82 110.747 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 44' ' ' ASN . . . . . 0.938 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 15.3 m120 -89.47 135.4 33.62 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.542 -0.54 . . . . 10.16 109.542 179.331 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 45' ' ' ILE . . . . . 0.45 HG21 ' HZ ' ' B' ' 61' ' ' PHE . 19.0 tt -61.96 -26.39 39.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.156 0.503 . . . . 9.62 110.634 179.343 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 46' ' ' VAL . . . . . 0.539 HG12 ' HB3' ' B' ' 44' ' ' ASN . 14.4 p -71.24 -22.1 22.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 CA-C-N 115.815 -0.629 . . . . 11.5 111.353 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 47' ' ' GLU . . . . . 0.938 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 35.9 mt-10 -69.69 -35.86 75.47 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.087 0.47 . . . . 11.89 110.652 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 48' ' ' PHE . . . . . 0.4 ' HE2' ' HB3' ' B' ' 43' ' ' LYS . 16.8 m-85 -97.11 8.78 43.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.883 -0.599 . . . . 13.6 109.915 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 44.4 t -93.27 147.79 22.6 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.861 -0.609 . . . . 10.81 110.858 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 5.4 t-160 -58.7 128.75 84.26 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.47 -0.787 . . . . 11.49 109.595 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -46.91 -51.09 9.77 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.186 2.591 . . . . 11.35 113.412 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -68.35 -5.26 17.84 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.311 0.486 . . . . 9.28 112.311 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -120.8 5.5 10.48 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.692 0.282 . . . . 7.52 111.185 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -64.07 -52.43 59.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.443 -0.344 . . . . 6.57 111.312 -179.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 55' ' ' GLN . . . . . 0.541 ' OE1' ' HD3' ' B' ' 58' ' ' ARG . 51.9 tp60 -63.95 -30.8 71.85 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.849 -0.426 . . . . 6.58 109.849 179.107 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.7 tp -59.17 -50.55 73.59 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.213 -0.662 . . . . 4.6 109.213 178.435 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.438 ' HA ' HD23 ' B' ' 57' ' ' LEU . 0.3 OUTLIER -67.56 -41.42 84.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.765 -0.652 . . . . 6.4 109.88 178.837 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 58' ' ' ARG . . . . . 0.541 ' HD3' ' OE1' ' B' ' 55' ' ' GLN . 38.5 ttt180 -55.21 -53.46 55.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.484 -0.78 . . . . 8.18 111.358 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 59' ' ' ASP . . . . . 0.458 ' O ' ' HG3' ' B' ' 63' ' ' GLN . 22.3 t70 -62.71 -37.81 87.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.468 -0.333 . . . . 6.07 110.453 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 50.9 m -61.67 -35.56 78.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 5.59 110.58 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 61' ' ' PHE . . . . . 0.544 ' O ' HG12 ' B' ' 64' ' ' VAL . 8.1 m-85 -63.59 -43.31 97.34 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 121.042 0.449 . . . . 7.73 109.901 178.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 58.1 mm-40 -68.47 -34.95 76.83 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.475 -0.565 . . . . 6.89 109.475 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' B' ' 59' ' ' ASP . 52.9 mt-30 -61.67 -47.53 84.94 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.702 -0.681 . . . . 9.4 110.968 179.58 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.544 HG12 ' O ' ' B' ' 61' ' ' PHE . 4.0 p -65.45 -29.82 48.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.402 -0.363 . . . . 7.57 111.216 -179.27 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 65' ' ' VAL . . . . . 0.505 HG23 ' O ' ' B' ' 61' ' ' PHE . 72.7 t -69.54 -37.51 74.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 109.455 -0.572 . . . . 7.43 109.455 178.649 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -72.0 -27.28 62.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.663 -0.699 . . . . 10.21 110.081 178.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.484 ' HB3' ' HB2' ' B' ' 70' ' ' GLN . 52.2 mt -73.08 -61.69 1.73 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.646 -0.706 . . . . 7.2 110.531 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 37.0 mttt 65.52 108.99 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.298 0 O-C-N 123.876 0.735 . . . . 7.58 111.471 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 79.4 14.16 81.8 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.811 -0.709 . . . . 5.57 112.297 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.484 ' HB2' ' HB3' ' B' ' 67' ' ' LEU . 1.3 mp0 -125.19 157.37 36.65 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.237 -0.653 . . . . 5.43 109.237 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 71' ' ' VAL . . . . . 0.554 HG11 ' HA ' ' A' ' 8' ' ' GLN . 13.4 p -107.75 136.51 42.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.377 0.608 . . . . 5.65 111.121 -179.52 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 11.5 tp -123.25 111.44 16.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.696 -0.684 . . . . 4.51 109.938 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 73' ' ' SER . . . . . 0.412 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 0.3 OUTLIER -89.13 117.02 27.82 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.125 -0.489 . . . . 6.35 111.038 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 7.6 p -116.18 135.87 54.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.753 -0.462 . . . . 4.34 109.753 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 22.8 ttt -106.91 110.57 22.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.21 0.528 . . . . 5.42 111.142 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.411 ' HE2' ' HD1' ' B' ' 78' ' ' PHE . 45.1 p90 -137.07 -178.98 5.44 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.661 -0.7 . . . . 3.54 109.245 179.661 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 77' ' ' ARG . . . . . 0.583 ' HD2' ' HB3' ' B' ' 85' ' ' TRP . 37.9 mtm180 -106.5 122.2 45.81 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.08 0.467 . . . . 6.8 110.626 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.624 ' HD2' HG11 ' B' ' 33' ' ' VAL . 15.6 t80 -103.81 150.58 23.98 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.64 -0.709 . . . . 5.79 109.889 -179.419 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 79' ' ' ARG . . . . . 0.429 HH11 ' HD3' ' B' ' 79' ' ' ARG . 30.1 ttp180 -89.62 134.22 34.24 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.383 -0.371 . . . . 11.08 110.468 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 82.0 p -93.29 -176.38 4.12 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.217 -0.447 . . . . 7.47 110.087 179.331 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -70.73 -14.93 62.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.428 0.632 . . . . 12.24 109.391 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 68.5 m-20 -92.11 1.08 57.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.373 -0.83 . . . . 9.25 109.489 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 83' ' ' GLN . . . . . 0.425 ' HA ' ' HG2' ' B' ' 79' ' ' ARG . 2.3 mp0 67.03 22.79 9.9 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.167 -0.924 . . . . 8.3 111.241 -179.463 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -94.31 157.2 16.15 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.465 -0.569 . . . . 6.78 109.465 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 85' ' ' TRP . . . . . 0.583 ' HB3' ' HD2' ' B' ' 77' ' ' ARG . 81.6 m95 -99.38 116.45 31.57 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.832 0.348 . . . . 7.89 110.835 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 pp -119.32 145.83 45.81 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.174 -0.467 . . . . 6.97 110.027 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 87' ' ' TRP . . . . . 0.42 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 94.7 m95 -76.39 120.62 21.89 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.098 0.475 . . . . 8.55 110.777 -179.399 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 30.7 tpp -119.62 128.99 54.37 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.49 -0.777 . . . . 4.46 111.166 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 20.4 ttp180 -99.2 82.54 2.72 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.714 -0.847 . . . . 6.87 108.714 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 90' ' ' THR . . . . . 0.493 HG23 ' HB3' ' B' ' 108' ' ' CYS . 47.8 m -75.66 114.87 14.74 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.534 -0.757 . . . . 6.18 111.712 -178.711 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 91' ' ' SER . . . . . 0.412 ' HA ' ' HA ' ' B' ' 73' ' ' SER . 1.4 m -96.73 95.93 8.25 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.565 -0.743 . . . . 6.3 109.119 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 10.3 m -84.07 123.4 30.0 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.185 -0.461 . . . . 6.65 112.028 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 93' ' ' PHE . . . . . 0.46 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 65.0 t80 -120.48 122.58 40.97 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.92 -0.582 . . . . 6.45 109.555 179.123 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.79 113.89 21.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.708 0.29 . . . . 9.17 111.368 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 95' ' ' PHE . . . . . 0.491 ' HD1' ' HA ' ' B' ' 95' ' ' PHE . 0.0 OUTLIER -82.68 122.6 28.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 8.33 110.188 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -98.45 119.35 36.99 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.705 -0.679 . . . . 10.53 111.041 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 97' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -71.27 123.76 89.89 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 108.78 -0.822 . . . . 8.43 108.78 178.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.68 21.67 0.17 Allowed 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.023 2.482 . . . . 9.16 114.151 -178.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -94.69 -68.72 0.79 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.564 -0.532 . . . . 11.34 109.564 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 6.1 m -129.66 20.1 5.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.088 -0.505 . . . . 7.75 110.252 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 33.7 t70 66.72 41.54 2.93 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.349 -0.842 . . . . 9.08 111.19 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -96.2 140.06 31.45 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.403 -0.362 . . . . 7.71 110.258 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 63.5 mt -79.63 108.83 13.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.561 -0.533 . . . . 8.04 109.561 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.472 ' H ' ' HG2' ' B' ' 104' ' ' GLU . 6.4 pt-20 -72.94 -45.18 59.52 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.519 -0.309 . . . . 8.81 111.025 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -165.55 167.6 17.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.455 -0.339 . . . . 7.4 110.382 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 67.5 mt -106.0 121.85 58.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.959 -0.564 . . . . 6.78 110.155 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.568 HG23 HG13 ' B' ' 13' ' ' ILE . 83.4 mt -87.75 100.03 9.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.893 -0.594 . . . . 6.31 109.734 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 108' ' ' CYS . . . . . 0.493 ' HB3' HG23 ' B' ' 90' ' ' THR . 68.1 m -100.6 97.91 8.54 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 120.823 -0.351 . . . . 5.31 111.522 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 46.3 m -75.36 99.29 4.08 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.121 -0.696 . . . . 5.48 109.121 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 110' ' ' ASN . . . . . 0.553 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.3 m-20 -80.46 109.27 14.81 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.654 -0.703 . . . . 6.9 110.899 -178.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 111' ' ' THR . . . . . 0.472 HG23 ' HB2' ' B' ' 11' ' ' GLU . 0.3 OUTLIER -113.09 110.88 21.19 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.114 -0.494 . . . . 8.61 110.127 179.245 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 112' ' ' ASN . . . . . 0.722 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 10.8 t-20 -70.59 129.77 40.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.992 0.425 . . . . 11.84 110.754 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 38.8 t -106.36 -51.16 7.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.838 -0.619 . . . . 11.77 110.057 179.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 114' ' ' LYS . . . . . 0.42 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 34.4 mtpt . . . . . 0 C--O 1.246 0.889 0 CA-C-O 118.567 -0.73 . . . . 12.68 110.217 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 75.5 m . . . . . 0 N--CA 1.474 0.76 0 CA-C-O 120.79 0.329 . . . . 15.6 110.407 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.2 mm-40 -101.29 104.25 31.95 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.839 -0.619 . . . . 15.08 109.831 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.89 153.85 67.86 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.742 2.295 . . . . 13.43 112.751 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.812 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.2 OUTLIER -79.53 52.49 1.4 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.347 0.594 . . . . 11.09 111.079 179.609 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.496 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 40.8 tt0 -152.37 123.75 7.72 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.417 -0.81 . . . . 10.59 108.825 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.784 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 44.7 p90 -139.79 151.11 45.5 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.066 0.46 . . . . 8.93 111.732 -178.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.596 HG13 HD13 ' B' ' 107' ' ' ILE . 0.0 OUTLIER -111.32 129.31 66.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.784 -0.644 . . . . 8.66 109.866 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.5 m -134.32 139.29 45.57 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.316 0.579 . . . . 6.11 112.35 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.6 ' HD2' ' HD2' ' A' ' 24' ' ' PHE . 6.5 mtt85 -89.54 133.37 34.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.161 -0.927 . . . . 9.09 108.978 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.516 ' CB ' ' HA ' ' A' ' 22' ' ' PHE . 33.5 p80 -154.89 158.69 39.71 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.183 0.516 . . . . 9.79 111.751 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -65.85 155.7 35.53 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.992 -1.004 . . . . 12.69 109.278 178.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 18.4 pt -53.87 -31.02 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 N-CA-C 112.406 0.521 . . . . 13.58 112.406 -179.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -75.12 -16.59 60.53 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.821 0.343 . . . . 13.85 111.83 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 120.58 -19.48 9.08 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.308 -0.949 . . . . 9.38 113.553 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.487 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 30.6 mm -57.5 110.36 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 116.829 0.314 . . . . 10.74 110.978 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.516 ' HA ' ' CB ' ' A' ' 16' ' ' HIS . 82.3 m-85 -71.95 138.78 48.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.973 0.416 . . . . 9.73 111.457 -179.593 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.6 m -115.4 -36.9 4.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.756 -0.656 . . . . 7.74 110.891 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.6 ' HD2' ' HD2' ' A' ' 15' ' ' ARG . 18.6 t80 -139.48 110.7 6.95 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.409 -0.589 . . . . 6.92 109.409 179.318 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.546 HG21 ' HB2' ' A' ' 40' ' ' LEU . 7.3 t -97.61 150.24 4.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 116.447 -0.342 . . . . 6.02 110.776 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.784 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 7.8 t70 -69.35 172.58 6.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.704 -0.68 . . . . 7.31 110.087 179.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -91.02 -21.38 21.3 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.124 0.488 . . . . 11.67 109.828 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 76.5 mtm180 -84.41 5.69 26.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.633 -0.712 . . . . 11.91 111.943 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 4.5 p -59.94 -42.92 95.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.323 0.582 . . . . 12.99 110.441 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.1 t -66.45 -28.88 44.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.522 -0.763 . . . . 16.15 111.04 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.24 -6.12 59.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.16 -0.473 . . . . 15.07 111.684 -179.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.487 ' HA ' HG22 ' A' ' 10' ' ' THR . 18.4 m -109.71 -56.99 2.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.724 0.297 . . . . 14.9 111.334 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.593 HG23 ' H ' ' A' ' 35' ' ' TYR . 11.1 m -113.17 -19.61 6.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.704 0.288 . . . . 13.84 111.702 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 94.51 -8.84 71.73 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.462 -0.875 . . . . 13.85 112.359 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.593 ' H ' HG23 ' A' ' 33' ' ' VAL . 4.6 m-85 -74.01 136.76 43.17 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.377 -0.231 . . . . 18.28 110.377 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.529 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 12.0 mm100 -80.7 153.54 73.16 Favored Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 109.139 -0.689 . . . . 15.48 109.139 178.686 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.572 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 52.6 Cg_exo -53.56 -38.97 84.18 Favored 'Trans proline' 0 CA--C 1.529 0.237 0 C-N-CA 122.568 2.179 . . . . 11.63 112.712 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -71.11 -14.63 62.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.219 -0.446 . . . . 13.31 111.665 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.529 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 34.2 mt-10 -82.31 -20.65 36.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.911 0.386 . . . . 17.34 110.366 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.546 ' HB2' HG21 ' A' ' 25' ' ' VAL . 3.3 mm? -95.51 -24.11 16.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.771 -0.649 . . . . 13.25 110.495 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 82.5 mt -61.0 122.79 15.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.849 -0.614 . . . . 12.99 111.028 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLY . . . . . 0.405 ' HA2' HG23 ' A' ' 21' ' ' ILE . . . 76.31 9.18 85.82 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.879 -0.677 . . . . 13.39 112.586 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.738 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 9.0 mmpt? -114.1 153.39 29.57 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.908 0.385 . . . . 16.87 110.667 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.512 ' HB3' HG12 ' A' ' 46' ' ' VAL . 16.2 m120 -94.84 138.22 32.9 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.85 -0.613 . . . . 12.5 109.48 179.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.7 tt -61.14 -23.23 29.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.146 0.498 . . . . 11.72 110.856 179.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.512 HG12 ' HB3' ' A' ' 44' ' ' ASN . 11.5 p -70.8 -20.71 22.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 116.075 -0.511 . . . . 12.89 111.432 -179.669 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.405 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 45.3 mt-10 -72.75 -39.24 66.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.194 0.521 . . . . 16.53 110.461 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -97.36 19.44 13.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.679 -0.691 . . . . 15.34 110.396 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.506 ' SG ' HD12 ' A' ' 57' ' ' LEU . 49.8 t -104.56 149.5 25.45 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.837 -0.619 . . . . 11.97 110.513 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.406 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 4.9 t-160 -58.16 125.31 74.26 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.507 -0.77 . . . . 14.67 109.335 178.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.454 ' HA ' ' CD ' ' A' ' 54' ' ' GLN . 88.5 Cg_exo -48.89 -38.99 39.52 Favored 'Trans proline' 0 CA--C 1.533 0.452 0 C-N-CA 123.089 2.526 . . . . 15.15 113.823 -178.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -81.46 0.67 36.69 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.939 0.348 . . . . 16.47 111.939 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.406 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 36.7 m-20 -125.76 2.31 7.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.831 0.348 . . . . 13.16 110.978 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.454 ' CD ' ' HA ' ' A' ' 51' ' ' PRO . 85.5 mt-30 -61.99 -39.76 93.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.134 -0.484 . . . . 15.83 111.059 -179.395 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 -66.74 -44.38 81.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.262 -0.426 . . . . 13.94 110.211 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.2 tp -59.96 -41.97 93.08 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.218 -0.446 . . . . 12.11 110.37 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.506 HD12 ' SG ' ' A' ' 49' ' ' CYS . 0.2 OUTLIER -62.56 -53.09 59.91 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.003 -0.544 . . . . 9.71 110.114 179.307 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.427 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 52.7 ttt180 -59.77 -45.52 92.01 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.581 -0.736 . . . . 11.06 111.412 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -58.58 -46.72 86.32 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.335 -0.393 . . . . 9.71 111.025 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.3 m -66.46 -33.65 76.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.201 -0.454 . . . . 9.52 110.812 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.466 ' O ' HG12 ' A' ' 64' ' ' VAL . 1.8 m-30 -64.44 -30.08 71.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.065 0.459 . . . . 11.4 109.924 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 58' ' ' ARG . 87.7 mm-40 -79.13 -31.72 44.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.855 -0.611 . . . . 10.04 110.236 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -66.49 -42.49 87.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.876 -0.602 . . . . 10.6 110.972 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.466 HG12 ' O ' ' A' ' 61' ' ' PHE . 9.5 p -64.01 -25.98 39.43 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-O 121.011 0.434 . . . . 10.62 110.399 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.499 ' HA ' HG21 ' A' ' 94' ' ' THR . 82.7 t -72.58 -38.31 58.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 109.382 -0.599 . . . . 12.41 109.382 178.445 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 41.5 mtpt -68.98 -40.81 78.57 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.717 -0.674 . . . . 16.25 110.022 179.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.703 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 86.9 mt -62.57 -49.63 74.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.669 -0.696 . . . . 12.66 110.75 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 62.5 mttt 66.01 99.37 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.815 -0.63 . . . . 14.83 112.394 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 82.16 14.37 77.04 Favored Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 121.029 -0.605 . . . . 9.8 113.356 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.703 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 52.0 tp60 -119.74 123.62 44.19 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.551 -0.537 . . . . 9.59 109.551 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 6.8 p -71.35 126.32 31.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.297 0.57 . . . . 8.1 111.128 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 22.4 tp -115.73 123.97 49.64 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.811 -0.631 . . . . 7.8 109.706 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -92.54 116.7 29.23 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.085 -0.507 . . . . 7.59 111.262 -179.48 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.1 p -119.56 122.8 69.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.106 0.479 . . . . 7.84 110.253 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 11.7 ttt -100.36 127.31 46.71 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.259 -0.428 . . . . 9.35 111.172 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.502 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 45.3 p90 -154.18 -179.57 8.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.915 -0.584 . . . . 9.66 109.755 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.474 ' HD2' ' HB3' ' A' ' 85' ' ' TRP . 11.4 mtm180 -100.86 119.83 39.25 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.907 0.384 . . . . 13.1 109.987 179.25 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.502 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 21.5 t80 -104.9 150.59 24.74 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.883 -0.598 . . . . 9.28 110.475 -179.105 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.54 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 28.3 ttp180 -86.5 133.08 33.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.323 -0.399 . . . . 10.87 110.573 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 59.8 p -93.11 -175.36 3.83 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.675 -0.491 . . . . 10.77 109.675 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.464 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 37.6 tptt -72.24 -14.65 61.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.25 0.548 . . . . 12.66 109.704 178.514 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -95.48 5.23 52.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.729 -0.668 . . . . 14.42 109.768 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 68.08 23.58 8.02 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.162 -0.926 . . . . 12.69 112.018 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.5 pt-20 -94.01 161.88 14.11 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.789 -0.449 . . . . 10.85 109.789 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.54 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 81.7 m95 -107.16 106.16 16.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.816 0.341 . . . . 11.2 110.288 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.486 HD21 HG12 ' A' ' 33' ' ' VAL . 1.6 pp -105.78 148.67 27.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.198 -0.455 . . . . 11.12 110.866 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.673 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 96.3 m95 -81.29 117.18 21.57 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.294 -0.412 . . . . 10.28 110.068 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.484 ' SD ' ' HB3' ' A' ' 110' ' ' ASN . 3.7 ttp -130.61 141.52 50.44 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.255 -0.43 . . . . 9.32 111.193 -179.015 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -103.25 100.49 10.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.717 -0.674 . . . . 10.66 109.323 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.525 HG23 ' HB3' ' A' ' 108' ' ' CYS . 37.7 m -82.91 113.93 20.85 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.247 0.546 . . . . 9.37 111.511 -179.289 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.673 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 0.7 OUTLIER -91.78 91.15 7.81 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.688 -0.856 . . . . 8.27 108.688 178.382 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.1 m -82.0 131.07 35.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.075 -0.511 . . . . 8.65 111.896 -178.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -127.12 121.6 31.88 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.771 -0.65 . . . . 11.56 109.812 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.499 HG21 ' HA ' ' A' ' 65' ' ' VAL . 0.0 OUTLIER -76.31 111.28 11.58 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.911 0.386 . . . . 10.16 110.695 179.717 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -81.44 100.73 9.44 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.136 0.493 . . . . 12.25 110.049 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.518 ' HG2' HG12 ' A' ' 103' ' ' ILE . 37.4 mt-30 -90.2 152.99 20.84 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.732 -0.667 . . . . 14.24 111.31 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.446 ' OD1' ' HB2' ' A' ' 99' ' ' TYR . 15.6 t-20 -102.82 130.35 23.99 Favored Pre-proline 0 C--N 1.32 -0.684 0 CA-C-N 115.427 -0.806 . . . . 13.83 109.046 179.049 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -76.22 54.62 4.29 Favored 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.576 2.184 . . . . 15.34 112.876 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.446 ' HB2' ' OD1' ' A' ' 97' ' ' ASN . 4.3 t80 -125.95 -55.25 1.49 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 16.89 110.348 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -138.41 22.2 2.75 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.983 -0.553 . . . . 14.89 109.746 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 10.0 t70 63.29 33.23 14.24 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.59 -0.732 . . . . 14.77 110.021 -179.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -90.45 162.58 15.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.92 -0.582 . . . . 12.95 110.289 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.518 HG12 ' HG2' ' A' ' 96' ' ' GLN . 43.8 mt -110.58 119.85 60.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.78 -0.452 . . . . 11.11 109.78 179.406 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.81 -40.76 27.85 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.856 -0.338 . . . . 11.65 110.737 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 14.4 p90 -169.16 -178.18 3.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.258 -0.428 . . . . 10.3 110.209 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 73.0 mt -121.59 127.16 75.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.876 0.37 . . . . 10.29 110.88 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.564 HG22 HG22 ' A' ' 13' ' ' ILE . 19.3 mt -99.62 122.3 51.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 108.623 -0.88 . . . . 8.99 108.623 178.554 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.525 ' HB3' HG23 ' A' ' 90' ' ' THR . 81.5 m -110.26 132.21 54.37 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.255 0.55 . . . . 9.83 112.452 -178.459 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.707 HG21 HG13 ' B' ' 13' ' ' ILE . 12.8 m -100.27 95.8 7.03 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.776 -1.102 . . . . 10.84 108.447 178.177 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.496 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 6.7 m-20 -81.93 105.85 13.38 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.093 -0.503 . . . . 11.26 111.839 -178.121 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 1.7 m -102.3 112.56 25.31 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.802 -0.635 . . . . 11.22 110.085 178.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ASN . . . . . 0.812 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 10.0 t-20 -72.47 125.28 27.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.905 0.383 . . . . 12.78 110.55 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 46.4 t -102.98 -50.21 9.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.158 -0.474 . . . . 14.64 109.897 179.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.673 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 89.8 mttt . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.283 -0.865 . . . . 16.02 110.09 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 80.3 m . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 109.939 -0.393 . . . . 7.49 109.939 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 8' ' ' GLN . . . . . 0.411 ' HA ' ' HD3' ' B' ' 9' ' ' PRO . 18.5 mm-40 -133.74 146.32 59.76 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 116.646 -0.252 . . . . 7.12 110.537 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 9' ' ' PRO . . . . . 0.706 ' HD2' ' HG2' ' B' ' 28' ' ' ARG . 18.1 Cg_exo -67.54 167.57 20.46 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 123.025 2.483 . . . . 6.18 112.104 179.306 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.97 57.89 3.62 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.479 0.656 . . . . 5.81 111.136 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.508 ' HA ' ' O ' ' B' ' 110' ' ' ASN . 0.0 OUTLIER -166.62 148.62 6.46 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.315 -0.995 . . . . 5.85 108.315 179.043 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 47.7 p90 -156.21 162.74 40.14 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.422 0.629 . . . . 6.08 112.06 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.707 HG13 HG21 ' A' ' 109' ' ' THR . 27.0 mm -96.33 117.35 40.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 114.912 -1.04 . . . . 5.57 110.409 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.468 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.9 OUTLIER -106.86 101.86 11.26 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.005 -0.543 . . . . 5.3 110.831 -179.769 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 15' ' ' ARG . . . . . 0.562 ' HD3' ' HB3' ' B' ' 24' ' ' PHE . 26.8 mtp85 -91.94 108.01 19.62 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.175 -0.676 . . . . 8.97 109.175 179.342 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 16' ' ' HIS . . . . . 0.553 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 31.9 p80 -139.55 164.46 29.84 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.345 -0.389 . . . . 8.31 110.897 -178.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 10.8 p-10 -75.71 -177.83 3.92 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.408 -0.36 . . . . 10.83 110.48 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 33.9 pt -65.64 -28.17 43.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 112.455 0.539 . . . . 8.89 112.455 -178.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -72.69 -32.75 66.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.724 0.297 . . . . 11.92 110.934 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 125.58 -11.4 7.52 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.578 -0.82 . . . . 8.57 112.267 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' ILE . . . . . 0.406 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 39.3 mm -62.12 112.64 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.775 0.321 . . . . 10.87 110.388 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 22' ' ' PHE . . . . . 0.553 ' HA ' ' HB3' ' B' ' 16' ' ' HIS . 97.2 m-85 -69.81 129.68 40.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.97 -0.559 . . . . 8.23 111.279 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.85 -33.91 7.82 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.82 -0.627 . . . . 7.91 110.607 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 24' ' ' PHE . . . . . 0.562 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 37.8 t80 -152.05 124.69 8.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.33 -0.396 . . . . 7.89 110.483 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 4.8 t -125.88 141.11 46.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.077 -0.511 . . . . 6.1 109.973 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -73.68 159.81 32.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.899 0.381 . . . . 7.15 110.222 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 89.3 m-70 -69.28 -10.34 57.39 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.088 -0.506 . . . . 8.97 112.036 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' ARG . . . . . 0.706 ' HG2' ' HD2' ' B' ' 9' ' ' PRO . 60.9 mtm180 -67.1 -20.06 65.73 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.429 0.529 . . . . 9.76 112.429 -179.202 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 32.1 p -59.75 -29.86 68.45 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.144 0.424 . . . . 11.56 112.144 -178.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.435 ' O ' ' HA2' ' B' ' 34' ' ' GLY . 21.8 t -61.94 -37.57 78.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.216 -0.447 . . . . 13.64 112.059 -178.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -91.85 -12.65 33.05 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.019 0.438 . . . . 12.9 111.181 -179.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 16.3 m -88.14 -64.71 1.1 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.252 -0.431 . . . . 12.13 111.368 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 33' ' ' VAL . . . . . 0.538 HG23 ' H ' ' B' ' 35' ' ' TYR . 6.9 m -108.64 -13.0 10.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.755 0.312 . . . . 13.87 111.614 -179.215 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 34' ' ' GLY . . . . . 0.435 ' HA2' ' O ' ' B' ' 30' ' ' VAL . . . 89.65 -12.68 66.32 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.573 -0.822 . . . . 13.79 112.003 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 35' ' ' TYR . . . . . 0.538 ' H ' HG23 ' B' ' 33' ' ' VAL . 14.9 m-85 -73.12 141.2 47.49 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.682 0.277 . . . . 15.38 110.632 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 36' ' ' GLN . . . . . 0.557 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 14.4 mm100 -84.64 148.65 52.31 Favored Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 108.902 -0.777 . . . . 13.78 108.902 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.715 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 52.4 Cg_exo -52.63 -39.78 74.91 Favored 'Trans proline' 0 N--CA 1.465 -0.153 0 C-N-CA 122.301 2.001 . . . . 14.71 111.986 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 26.0 mp0 -65.9 -20.24 66.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.938 -0.573 . . . . 17.54 112.22 -179.375 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.557 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 42.6 mt-10 -79.15 -39.35 33.74 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.892 -0.41 . . . . 14.24 109.892 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -73.41 -34.21 65.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.905 -0.589 . . . . 14.03 111.207 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.715 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 56.6 mt -59.18 114.66 2.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.96 0.409 . . . . 13.62 111.304 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 98.32 -7.72 62.11 Favored Glycine 0 N--CA 1.45 -0.422 0 CA-C-N 115.825 -0.625 . . . . 11.62 112.44 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.442 ' HE2' ' HA ' ' B' ' 43' ' ' LYS . 1.4 mmpt? -108.47 166.68 10.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.74 0.305 . . . . 13.82 110.925 -179.629 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 44' ' ' ASN . . . . . 0.805 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 12.8 m120 -103.04 149.33 24.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.801 -0.636 . . . . 10.16 109.959 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 18.9 tt -71.48 -27.34 28.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.957 0.408 . . . . 9.62 110.819 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 9.9 p -71.76 -20.53 20.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-O 120.986 0.422 . . . . 11.5 111.413 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 47' ' ' GLU . . . . . 0.805 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 41.8 mt-10 -70.52 -34.47 72.34 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.254 -0.43 . . . . 11.89 110.98 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -103.08 26.3 8.39 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.109 -0.496 . . . . 13.6 110.147 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 49.8 t -107.57 152.55 24.11 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.001 -0.545 . . . . 10.81 111.082 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 50' ' ' HIS . . . . . 0.456 ' HB2' ' HB2' ' B' ' 77' ' ' ARG . 8.8 t-80 -63.92 130.29 94.38 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 115.401 -0.818 . . . . 11.49 109.538 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 51' ' ' PRO . . . . . 0.436 ' HD2' ' CD2' ' B' ' 50' ' ' HIS . 85.9 Cg_exo -43.53 -51.18 6.28 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.606 2.871 . . . . 11.35 114.438 -179.307 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -72.98 -3.91 28.96 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.375 0.509 . . . . 9.28 112.375 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 53' ' ' ASP . . . . . 0.603 ' HB3' ' HB2' ' B' ' 76' ' ' PHE . 14.8 m-20 -118.35 3.86 11.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.986 0.422 . . . . 7.52 110.692 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -68.2 -48.23 65.79 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.919 -0.582 . . . . 6.57 111.524 -178.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 49.7 tp60 -65.23 -33.49 76.12 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.858 -0.423 . . . . 6.58 109.858 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 22.0 tp -61.38 -39.23 89.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.963 -0.562 . . . . 4.6 109.993 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 1.1 mt -66.39 -47.47 73.23 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.786 -0.643 . . . . 6.4 110.272 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -61.95 -46.09 90.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.807 -0.633 . . . . 8.18 111.036 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -58.95 -45.68 89.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.47 . . . . 6.07 111.056 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 15.7 m -66.84 -36.4 82.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.247 -0.433 . . . . 5.59 110.869 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 61' ' ' PHE . . . . . 0.633 ' O ' HG12 ' B' ' 64' ' ' VAL . 1.7 m-30 -64.64 -42.8 95.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.732 0.301 . . . . 7.73 110.539 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 84.3 mm-40 -65.17 -28.75 69.62 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.079 0.466 . . . . 6.89 110.405 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -76.82 -37.86 54.94 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.993 -0.549 . . . . 9.4 111.021 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.727 ' HA ' HD12 ' B' ' 67' ' ' LEU . 2.8 p -65.74 -27.46 41.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 CA-C-O 120.775 0.321 . . . . 7.57 110.474 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 65' ' ' VAL . . . . . 0.444 HG23 ' O ' ' B' ' 61' ' ' PHE . 92.4 t -69.77 -34.77 62.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.327 0.585 . . . . 7.43 109.605 178.613 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -80.27 -18.26 49.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.636 -0.711 . . . . 10.21 110.439 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.85 ' HB3' ' HB2' ' B' ' 70' ' ' GLN . 64.8 mt -74.3 -46.92 38.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.862 -0.608 . . . . 7.2 110.572 179.326 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 86.2 mttt 56.6 88.46 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.85 0.719 . . . . 7.58 112.538 179.16 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.55 -4.0 63.73 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.431 -0.89 . . . . 5.57 112.533 178.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.85 ' HB2' ' HB3' ' B' ' 67' ' ' LEU . 2.3 mp0 -104.68 141.53 36.28 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 110.164 -0.31 . . . . 5.43 110.164 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 71' ' ' VAL . . . . . 0.832 ' HB ' ' HD1' ' B' ' 93' ' ' PHE . 7.1 p -92.94 132.33 37.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.151 0.5 . . . . 5.65 111.054 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 14.9 tp -119.98 111.73 18.28 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.917 -0.583 . . . . 4.51 109.435 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 73' ' ' SER . . . . . 0.611 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.2 p -91.24 110.29 21.57 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.208 -0.451 . . . . 6.35 110.926 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.1 p -103.83 128.69 56.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.122 -0.49 . . . . 4.34 110.107 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 28.4 ttt -99.29 109.11 21.78 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.366 -0.379 . . . . 5.42 110.292 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.603 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 51.5 p90 -138.6 -173.64 3.61 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.058 -0.519 . . . . 3.54 110.121 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 77' ' ' ARG . . . . . 0.456 ' HB2' ' HB2' ' B' ' 50' ' ' HIS . 26.3 mtt180 -106.64 115.61 30.49 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.754 0.311 . . . . 6.8 110.32 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -102.64 149.45 24.43 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.035 -0.53 . . . . 5.79 110.021 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 79' ' ' ARG . . . . . 0.584 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 17.5 ttp180 -88.88 133.06 34.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.925 0.393 . . . . 11.08 110.618 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 80' ' ' SER . . . . . 0.492 ' OG ' ' HG2' ' B' ' 84' ' ' GLU . 91.0 p -94.58 -176.33 3.88 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.683 -0.488 . . . . 7.47 109.683 178.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 81' ' ' LYS . . . . . 0.444 ' HA ' ' HD2' ' B' ' 81' ' ' LYS . 40.2 tptt -68.26 -16.22 63.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.27 0.557 . . . . 12.24 110.014 179.077 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -88.11 -0.54 57.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.678 -0.692 . . . . 9.25 109.884 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 65.93 28.78 10.54 Favored 'General case' 0 C--N 1.334 -0.076 0 CA-C-N 115.551 -0.75 . . . . 8.3 110.795 -179.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 84' ' ' GLU . . . . . 0.492 ' HG2' ' OG ' ' B' ' 80' ' ' SER . 12.2 pt-20 -106.53 163.72 12.65 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.031 -0.729 . . . . 6.78 109.031 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 85' ' ' TRP . . . . . 0.584 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 49.9 m95 -105.15 127.76 53.06 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.135 0.493 . . . . 7.89 111.426 -179.247 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -129.26 151.3 50.06 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.792 -0.64 . . . . 6.97 109.814 179.049 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 87' ' ' TRP . . . . . 0.541 ' HD1' ' HB2' ' B' ' 114' ' ' LYS . 98.8 m95 -75.65 111.57 11.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.358 0.599 . . . . 8.55 110.511 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 88' ' ' MET . . . . . 0.414 ' SD ' ' HB3' ' B' ' 110' ' ' ASN . 47.0 tpp -116.0 123.44 48.01 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.248 -0.887 . . . . 4.46 110.722 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 33.3 ttp180 -97.76 83.27 3.16 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.592 -0.892 . . . . 6.87 108.592 178.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 90' ' ' THR . . . . . 0.636 HG23 ' HB3' ' B' ' 108' ' ' CYS . 36.2 m -72.06 109.45 5.87 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.418 -0.81 . . . . 6.18 111.231 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 91' ' ' SER . . . . . 0.67 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 1.9 m -90.38 87.89 6.97 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.697 -0.683 . . . . 6.3 109.339 179.187 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 92' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' B' ' 108' ' ' CYS . 9.2 m -75.39 120.46 20.87 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.84 -0.618 . . . . 6.65 111.517 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 93' ' ' PHE . . . . . 0.832 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 55.8 t80 -116.88 124.22 48.94 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.943 -0.572 . . . . 6.45 110.085 179.616 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 94' ' ' THR . . . . . 0.522 HG22 HG21 ' B' ' 103' ' ' ILE . 0.3 OUTLIER -83.69 103.26 12.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.881 0.372 . . . . 9.17 110.691 179.76 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 95' ' ' PHE . . . . . 0.483 ' CZ ' ' HB ' ' A' ' 13' ' ' ILE . 0.0 OUTLIER -74.62 117.17 16.15 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.156 -0.474 . . . . 8.33 110.52 -179.647 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -83.25 116.91 22.62 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.751 -0.659 . . . . 10.53 110.584 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 97' ' ' ASN . . . . . 0.484 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 62.7 t30 -80.74 127.84 73.83 Favored Pre-proline 0 C--N 1.322 -0.625 0 N-CA-C 109.251 -0.648 . . . . 8.43 109.251 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 98' ' ' PRO . . . . . 0.484 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 23.5 Cg_endo -62.32 73.27 0.11 Allowed 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.257 2.638 . . . . 9.16 113.054 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 99' ' ' TYR . . . . . 0.424 ' HB3' ' H ' ' B' ' 100' ' ' SER . 3.6 m-85 -147.4 -137.58 0.09 Allowed 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.818 -0.808 . . . . 11.34 108.818 179.425 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 100' ' ' SER . . . . . 0.424 ' H ' ' HB3' ' B' ' 99' ' ' TYR . 0.3 OUTLIER -80.54 49.3 1.15 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.665 0.269 . . . . 7.75 110.968 179.437 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 38.8 t70 50.53 77.0 0.13 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.719 -0.673 . . . . 9.08 111.101 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 102' ' ' GLU . . . . . 0.463 ' HG3' ' HB3' ' B' ' 97' ' ' ASN . 3.4 pt-20 -133.43 151.46 51.8 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.946 0.403 . . . . 7.71 111.459 -179.143 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 103' ' ' ILE . . . . . 0.522 HG21 HG22 ' B' ' 94' ' ' THR . 40.2 mt -94.9 98.3 7.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.638 -0.71 . . . . 8.04 109.146 178.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -58.45 -47.8 82.8 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.985 -0.552 . . . . 8.81 110.723 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 105' ' ' TYR . . . . . 0.445 ' HE1' HD11 ' B' ' 107' ' ' ILE . 8.1 p90 -161.31 163.49 30.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.104 -0.498 . . . . 7.4 110.133 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 62.6 mt -105.16 114.32 44.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.896 -0.593 . . . . 6.78 109.686 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.688 HG23 HG23 ' B' ' 13' ' ' ILE . 88.1 mt -86.87 104.21 13.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.008 -0.542 . . . . 6.31 109.697 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 108' ' ' CYS . . . . . 0.636 ' HB3' HG23 ' B' ' 90' ' ' THR . 75.6 m -94.43 108.49 20.41 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.967 -0.561 . . . . 5.31 111.632 -179.179 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 109' ' ' THR . . . . . 0.67 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 27.5 m -82.47 90.94 6.79 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.94 -0.763 . . . . 5.48 108.94 177.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 110' ' ' ASN . . . . . 0.508 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.0 m-20 -72.24 106.86 4.59 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.836 -0.62 . . . . 6.9 111.363 -178.599 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 1.4 m -108.72 109.03 20.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.308 -0.406 . . . . 8.61 110.189 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -70.95 127.07 31.35 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.987 0.422 . . . . 11.84 110.586 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 113' ' ' VAL . . . . . 0.4 HG12 ' HG3' ' B' ' 114' ' ' LYS . 35.2 t -100.23 -55.46 5.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.769 -0.65 . . . . 11.77 109.751 179.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 114' ' ' LYS . . . . . 0.541 ' HB2' ' HD1' ' B' ' 87' ' ' TRP . 45.4 mtpt . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.516 -0.754 . . . . 12.68 109.703 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 80.0 m . . . . . 0 N--CA 1.477 0.925 0 N-CA-C 110.328 -0.249 . . . . 15.6 110.328 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.7 mm-40 -101.39 106.95 48.64 Favored Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 109.689 -0.485 . . . . 15.08 109.689 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.65 164.85 34.41 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.769 2.312 . . . . 13.43 112.556 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.716 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.2 OUTLIER -82.89 52.0 2.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.154 0.502 . . . . 11.09 110.975 179.737 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.44 ' HB2' HG23 ' A' ' 111' ' ' THR . 40.2 tt0 -156.41 129.97 8.26 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.782 -0.645 . . . . 10.59 109.479 -179.298 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.945 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 39.4 p90 -144.83 145.11 31.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.937 0.399 . . . . 8.93 111.425 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.51 HG23 HG23 ' A' ' 107' ' ' ILE . 2.5 mp -93.57 117.93 38.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 109.795 -0.446 . . . . 8.66 109.795 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 52.8 p -105.16 121.97 44.94 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.233 0.539 . . . . 6.11 111.057 -179.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.9 mtp180 -97.85 102.9 14.77 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.303 -0.999 . . . . 9.09 108.303 178.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.407 ' O ' ' HB2' ' A' ' 105' ' ' TYR . 31.8 p80 -130.46 153.85 48.36 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.511 -0.313 . . . . 9.79 110.931 -178.598 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -69.18 173.98 5.1 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.475 -0.329 . . . . 12.69 110.236 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.0 pt -58.83 -29.51 40.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 112.802 0.667 . . . . 13.58 112.802 -178.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -73.94 -21.38 60.06 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.887 0.375 . . . . 13.85 111.465 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 112.12 -0.93 26.92 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 120.436 -0.888 . . . . 9.38 112.509 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.423 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 40.2 mm -72.98 118.45 18.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.679 -0.489 . . . . 10.74 109.679 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.418 ' CG ' ' HB3' ' A' ' 40' ' ' LEU . 86.9 m-85 -69.41 113.63 6.89 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.183 -0.462 . . . . 9.73 111.507 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.83 -35.95 23.85 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.355 0.598 . . . . 7.74 109.659 178.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -152.78 125.85 8.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.312 -0.858 . . . . 6.92 108.985 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.62 HG21 ' HB2' ' A' ' 40' ' ' LEU . 2.5 t -110.35 147.88 14.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.953 0.406 . . . . 6.02 111.414 -178.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.945 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 6.4 t70 -68.81 168.9 12.46 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.874 -0.603 . . . . 7.31 109.764 179.145 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 60.5 m170 -95.34 -11.96 26.9 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.995 0.426 . . . . 11.67 110.574 -179.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 85.6 mtm180 -82.0 -5.94 58.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.895 -0.593 . . . . 11.91 111.947 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.6 p -60.88 -27.37 68.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.867 0.365 . . . . 12.99 111.163 -179.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.436 ' O ' ' HA2' ' A' ' 34' ' ' GLY . 15.0 t -65.14 -32.67 59.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.045 -0.525 . . . . 16.15 110.823 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.52 -27.19 21.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.182 -0.463 . . . . 15.07 110.787 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.559 ' HA ' HG22 ' A' ' 10' ' ' THR . 4.0 m -76.63 -55.37 5.57 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.114 -0.494 . . . . 14.9 111.376 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.568 HG11 ' HD2' ' A' ' 78' ' ' PHE . 2.7 m -120.13 -30.07 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 111.871 0.322 . . . . 13.84 111.871 -179.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.436 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 110.48 -23.57 19.91 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.307 -0.949 . . . . 13.85 112.015 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -65.58 135.86 55.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.743 0.306 . . . . 18.28 110.529 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.638 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 17.7 mm100 -77.3 150.41 80.11 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 109.16 -0.682 . . . . 15.48 109.16 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.567 ' HB3' ' HB ' ' A' ' 25' ' ' VAL . 53.6 Cg_exo -52.36 -40.0 71.82 Favored 'Trans proline' 0 CA--C 1.528 0.202 0 C-N-CA 122.443 2.095 . . . . 11.63 112.05 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.579 ' HA ' HD12 ' A' ' 41' ' ' LEU . 25.7 mp0 -65.6 -20.34 66.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.621 -0.718 . . . . 13.31 111.612 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.638 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 29.3 mt-10 -78.74 -28.14 44.89 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.146 -0.316 . . . . 17.34 110.146 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.62 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.7 mm? -86.58 -26.9 24.23 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.879 -0.601 . . . . 13.25 110.791 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.579 HD12 ' HA ' ' A' ' 38' ' ' GLN . 96.7 mt -60.43 119.34 7.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.106 -0.497 . . . . 12.99 110.824 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.9 3.8 82.8 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 121.01 -0.614 . . . . 13.39 112.41 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.517 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 8.3 mmpt? -113.95 161.2 17.95 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.224 -0.287 . . . . 16.87 110.224 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.653 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 16.8 m120 -98.06 136.37 38.41 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.669 -0.493 . . . . 12.5 109.669 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.493 HD13 ' HZ ' ' A' ' 61' ' ' PHE . 13.8 tt -58.8 -27.55 35.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.106 0.479 . . . . 11.72 110.992 179.413 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.2 p -71.21 -18.68 20.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.051 -0.522 . . . . 12.89 111.56 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.653 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.0 mt-10 -71.14 -34.63 71.21 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.035 0.445 . . . . 16.53 110.901 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.414 ' HB2' ' CZ ' ' A' ' 78' ' ' PHE . 30.7 m-85 -100.45 24.14 9.31 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.903 -0.59 . . . . 15.34 110.471 -179.147 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 46.0 t -110.57 150.19 29.3 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.059 -0.519 . . . . 11.97 110.063 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.527 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 6.8 t-160 -58.33 125.17 74.51 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 109.133 -0.691 . . . . 14.67 109.133 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_exo -45.63 -46.36 15.04 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 123.189 2.592 . . . . 15.15 113.679 -179.014 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -75.82 0.03 19.48 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.121 0.415 . . . . 16.47 112.121 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.527 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 9.5 m-20 -122.03 -0.17 9.54 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.963 0.411 . . . . 13.16 110.246 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -63.9 -45.47 89.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.791 -0.64 . . . . 15.83 111.557 -179.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.7 tp60 -66.46 -37.0 84.18 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.433 -0.58 . . . . 13.94 109.433 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.8 tp -59.48 -42.1 91.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.727 -0.67 . . . . 12.11 109.445 178.413 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -67.73 -51.24 51.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.521 -0.763 . . . . 9.71 110.327 179.159 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -57.29 -47.22 82.03 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.767 -0.651 . . . . 11.06 111.606 -179.219 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.478 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 31.3 t70 -58.96 -45.89 89.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.32 -0.4 . . . . 9.71 110.983 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.4 m -65.87 -33.27 75.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.966 -0.561 . . . . 9.52 111.022 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.593 ' O ' HG12 ' A' ' 64' ' ' VAL . 1.9 m-85 -62.88 -39.47 94.54 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.051 0.453 . . . . 11.4 110.163 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 87.2 mm-40 -70.22 -32.0 69.68 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.043 -0.526 . . . . 10.04 110.092 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.645 ' HA ' ' HD3' ' A' ' 66' ' ' LYS . 65.7 mt-30 -66.08 -39.02 89.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.95 -0.568 . . . . 10.6 111.219 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.593 HG12 ' O ' ' A' ' 61' ' ' PHE . 2.3 p -68.14 -25.38 31.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.854 0.359 . . . . 10.62 110.687 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.427 ' O ' ' HG3' ' A' ' 68' ' ' LYS . 86.6 t -73.6 -34.82 42.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 N-CA-C 109.157 -0.683 . . . . 12.41 109.157 178.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.645 ' HD3' ' HA ' ' A' ' 63' ' ' GLN . 45.3 mtpt -72.23 -38.99 68.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.518 -0.765 . . . . 16.25 109.634 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 65.9 mt -66.01 -53.49 38.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.296 -0.865 . . . . 12.66 111.034 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' A' ' 65' ' ' VAL . 62.7 mttt 60.33 91.46 0.05 Allowed 'General case' 0 N--CA 1.466 0.326 0 O-C-N 123.658 0.599 . . . . 14.83 112.38 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 105.74 -13.6 46.15 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.726 -0.75 . . . . 9.8 112.804 179.105 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.521 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 6.3 tp-100 -96.67 126.25 41.7 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.269 -0.271 . . . . 9.59 110.269 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.448 ' HA ' ' O ' ' A' ' 92' ' ' SER . 2.4 p -80.75 112.93 19.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.333 0.587 . . . . 8.1 110.587 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.3 tp -104.29 117.33 33.94 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.616 -0.72 . . . . 7.8 110.398 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.76 106.93 18.39 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.863 -0.608 . . . . 7.59 111.193 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.472 HG13 ' HB ' ' A' ' 90' ' ' THR . 2.6 p -101.28 122.98 54.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.112 0.482 . . . . 7.84 109.867 179.184 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 23.6 ttt -99.78 118.42 36.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.243 -0.435 . . . . 9.35 110.954 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.588 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 45.4 p90 -145.9 -171.65 3.75 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.663 -0.699 . . . . 9.66 109.279 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.454 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 44.9 mtm180 -110.55 120.12 41.39 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.055 0.455 . . . . 13.1 110.398 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.588 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 12.7 t80 -102.25 151.88 21.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.316 -0.856 . . . . 9.28 110.15 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.492 ' HA ' ' O ' ' A' ' 84' ' ' GLU . 37.9 ttp180 -88.61 128.16 35.58 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.171 -0.468 . . . . 10.87 110.471 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.474 ' HA ' ' HB ' ' A' ' 33' ' ' VAL . 54.9 p -88.47 -176.25 5.25 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.299 -0.41 . . . . 10.77 110.025 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.4 tptt -72.33 -14.23 61.69 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.104 -0.702 . . . . 12.66 109.104 178.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -90.74 1.38 56.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.316 -0.856 . . . . 14.42 109.489 178.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 67.82 22.91 8.63 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.207 -0.906 . . . . 12.69 111.316 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.492 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.5 pt-20 -96.1 167.95 10.9 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.755 -0.461 . . . . 10.85 109.755 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.464 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 77.2 m95 -108.92 108.31 19.02 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.582 -0.281 . . . . 11.2 110.562 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.529 HD21 HG12 ' A' ' 33' ' ' VAL . 2.6 pp -110.0 151.09 27.58 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.488 -0.324 . . . . 11.12 110.365 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.538 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 96.9 m95 -77.59 119.66 21.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.039 0.447 . . . . 10.28 110.527 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.437 ' SD ' ' HB3' ' A' ' 110' ' ' ASN . 30.5 tpp -119.2 135.41 54.69 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.776 -0.647 . . . . 9.32 111.063 -178.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -104.72 81.69 1.8 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.65 -0.87 . . . . 10.66 108.65 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.598 HG23 ' HB3' ' A' ' 108' ' ' CYS . 28.7 m -71.38 109.51 5.41 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.689 -0.687 . . . . 9.37 111.963 -178.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.487 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 0.7 OUTLIER -87.51 93.42 9.41 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.431 -0.804 . . . . 8.27 108.982 178.697 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.448 ' O ' ' HA ' ' A' ' 71' ' ' VAL . 16.4 m -81.91 124.02 29.35 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.04 0.448 . . . . 8.65 111.452 -178.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -125.63 125.06 42.52 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.746 -0.661 . . . . 11.56 109.93 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.69 129.51 37.22 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.297 -0.411 . . . . 10.16 111.474 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -114.04 109.97 19.29 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.376 -0.375 . . . . 12.25 110.079 179.496 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.41 ' HG3' HG12 ' A' ' 103' ' ' ILE . 0.0 OUTLIER -112.55 152.91 28.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.997 0.427 . . . . 14.24 110.966 -179.694 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -92.37 145.87 31.43 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 109.15 -0.685 . . . . 13.83 109.15 178.563 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.15 28.61 0.36 Allowed 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 122.65 2.233 . . . . 15.34 113.288 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -98.7 -64.69 1.01 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.145 0.498 . . . . 16.89 110.001 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.449 ' HB2' ' HG3' ' A' ' 102' ' ' GLU . 49.5 m -133.24 17.98 4.06 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.686 -0.688 . . . . 14.89 109.648 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.9 t70 63.62 34.16 12.62 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.272 -0.877 . . . . 14.77 109.811 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.449 ' HG3' ' HB2' ' A' ' 100' ' ' SER . 0.1 OUTLIER -80.3 130.22 35.04 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.181 -0.918 . . . . 12.95 110.154 -179.796 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.41 HG12 ' HG3' ' A' ' 96' ' ' GLN . 36.7 mt -81.15 106.74 12.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.872 -0.418 . . . . 11.11 109.872 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -70.58 -43.81 68.65 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.728 0.299 . . . . 11.65 110.328 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.407 ' HB2' ' O ' ' A' ' 16' ' ' HIS . 31.6 p90 -165.5 172.4 12.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.211 -0.449 . . . . 10.3 110.295 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 52.1 mt -110.86 122.76 65.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.106 -0.497 . . . . 10.29 110.529 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.51 HG23 HG23 ' A' ' 13' ' ' ILE . 87.4 mt -84.56 110.72 19.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.311 -0.626 . . . . 8.99 109.311 179.163 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.598 ' HB3' HG23 ' A' ' 90' ' ' THR . 64.5 m -110.79 109.37 19.56 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.143 0.497 . . . . 9.83 111.505 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.722 HG21 HG13 ' B' ' 13' ' ' ILE . 22.5 m -83.78 100.01 10.65 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.823 -0.806 . . . . 10.84 108.823 178.608 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.437 ' HB3' ' SD ' ' A' ' 88' ' ' MET . 6.0 m-20 -84.68 101.57 12.28 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.989 -0.55 . . . . 11.26 111.549 -178.373 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.44 HG23 ' HB2' ' A' ' 11' ' ' GLU . 2.5 m -103.87 121.1 42.37 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.98 -0.555 . . . . 11.22 109.791 178.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ASN . . . . . 0.716 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 4.3 t30 -75.87 125.26 28.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.939 0.4 . . . . 12.78 110.826 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 61.7 t -98.55 -49.47 11.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.728 -0.669 . . . . 14.64 109.929 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.538 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 52.1 mtpt . . . . . 0 C--O 1.252 1.194 0 CA-C-O 118.483 -0.77 . . . . 16.02 110.388 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 72.4 m . . . . . 0 N--CA 1.477 0.88 0 CA-C-O 120.871 0.367 . . . . 7.49 110.23 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 8' ' ' GLN . . . . . 0.55 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 71.6 mm-40 -95.08 142.3 24.42 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.026 -0.534 . . . . 7.12 110.997 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 9' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' B' ' 8' ' ' GLN . 10.8 Cg_exo -72.87 171.99 16.29 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 123.099 2.533 . . . . 6.18 111.757 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.91 56.48 3.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.312 0.577 . . . . 5.81 111.082 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.66 ' HA ' ' O ' ' B' ' 110' ' ' ASN . 0.0 OUTLIER -162.85 141.74 8.69 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.399 -0.963 . . . . 5.85 108.399 179.722 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -152.47 165.73 34.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.334 0.588 . . . . 6.08 112.274 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.722 HG13 HG21 ' A' ' 109' ' ' THR . 9.1 mm -90.57 118.07 35.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 114.857 -1.065 . . . . 5.57 110.329 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.665 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.7 OUTLIER -106.31 94.49 5.18 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.773 -0.649 . . . . 5.3 110.293 179.639 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 15' ' ' ARG . . . . . 0.562 ' HG2' HG12 ' B' ' 107' ' ' ILE . 55.8 mtp180 -87.58 101.89 14.06 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.273 -0.64 . . . . 8.97 109.273 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 16' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' B' ' 105' ' ' TYR . 35.0 p80 -132.21 162.07 31.85 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.132 -0.486 . . . . 8.31 110.551 -179.064 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -83.17 177.91 8.34 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.517 -0.311 . . . . 10.83 110.291 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 26.6 pt -60.91 -20.88 22.8 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 113.24 0.83 . . . . 8.89 113.24 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -83.69 -14.42 51.8 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.196 0.522 . . . . 11.92 110.601 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 104.14 -6.34 46.72 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.486 -0.864 . . . . 8.57 111.901 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' ILE . . . . . 0.542 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 26.9 mm -70.03 117.21 12.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 110.021 -0.362 . . . . 10.87 110.021 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 22' ' ' PHE . . . . . 0.665 ' HE1' ' HB3' ' B' ' 14' ' ' SER . 97.0 m-85 -73.4 133.07 43.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.201 0.524 . . . . 8.23 111.829 -179.307 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -103.89 -35.3 8.2 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.479 -0.782 . . . . 7.91 110.018 178.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -148.04 129.55 14.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.794 -0.639 . . . . 7.89 110.246 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.568 HG21 ' HB2' ' B' ' 40' ' ' LEU . 12.4 t -124.23 126.49 72.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.479 -0.563 . . . . 6.1 109.479 179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -67.76 156.06 37.86 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.975 0.416 . . . . 7.15 110.765 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -62.59 -19.21 63.51 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.842 -0.617 . . . . 8.97 112.2 -178.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 28' ' ' ARG . . . . . 0.55 ' HG2' ' HB3' ' B' ' 8' ' ' GLN . 70.3 mtm180 -64.78 -16.73 63.42 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.839 0.311 . . . . 9.76 111.839 -179.8 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 30.3 p -60.77 -32.62 71.93 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 120.872 0.368 . . . . 11.56 111.099 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 18.1 t -64.51 -36.22 76.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 13.64 111.076 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.49 -19.13 31.67 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.985 0.422 . . . . 12.9 110.811 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 20.1 m -84.52 -57.93 2.94 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.152 -0.476 . . . . 12.13 111.889 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 33' ' ' VAL . . . . . 0.464 HG11 ' HD2' ' B' ' 78' ' ' PHE . 6.2 m -122.24 -5.01 8.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 N-CA-C 112.373 0.509 . . . . 13.87 112.373 -178.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.86 -18.21 36.51 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.471 -0.871 . . . . 13.79 112.962 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -67.05 136.96 56.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.734 0.302 . . . . 15.38 110.919 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 36' ' ' GLN . . . . . 0.633 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 13.8 mm100 -80.57 151.65 71.83 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 109.144 -0.687 . . . . 13.78 109.144 178.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.516 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 74.5 Cg_exo -50.61 -44.31 40.95 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.845 2.363 . . . . 14.71 112.864 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -65.11 -24.95 67.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.079 -0.509 . . . . 17.54 112.164 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.633 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 30.6 mt-10 -69.19 -25.82 64.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.805 0.336 . . . . 14.24 111.061 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.568 ' HB2' HG21 ' B' ' 25' ' ' VAL . 2.2 mm? -94.84 -21.27 18.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.226 -0.443 . . . . 14.03 110.873 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 52.5 mt -61.87 119.24 8.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.217 -0.447 . . . . 13.62 110.826 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 82.14 10.07 84.29 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.862 -0.685 . . . . 11.62 112.511 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.687 ' HE2' ' HA ' ' B' ' 43' ' ' LYS . 8.7 mmpt? -117.0 156.24 27.82 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 110.153 -0.314 . . . . 13.82 110.153 179.761 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 44' ' ' ASN . . . . . 0.731 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 13.5 m120 -93.29 135.93 34.04 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.153 -0.476 . . . . 10.16 109.91 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 45' ' ' ILE . . . . . 0.42 ' HB ' ' CZ ' ' B' ' 22' ' ' PHE . 15.4 tt -59.71 -26.27 34.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.285 0.564 . . . . 9.62 110.847 178.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 46' ' ' VAL . . . . . 0.401 HG12 ' HB3' ' B' ' 44' ' ' ASN . 9.8 p -71.17 -22.05 22.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.844 -0.616 . . . . 11.5 111.243 -179.707 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 47' ' ' GLU . . . . . 0.731 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 44.2 mt-10 -70.63 -30.04 66.58 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.968 0.413 . . . . 11.89 110.668 -179.596 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 48' ' ' PHE . . . . . 0.416 ' HE1' ' HB3' ' B' ' 43' ' ' LYS . 40.4 m-85 -105.37 21.06 17.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.933 -0.576 . . . . 13.6 110.447 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 53.4 t -104.52 151.98 22.93 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 116.004 -0.544 . . . . 10.81 110.411 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 50' ' ' HIS . . . . . 0.432 ' CD2' ' HD2' ' B' ' 51' ' ' PRO . 10.4 t-80 -61.61 126.54 87.03 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.817 -0.629 . . . . 11.49 109.542 178.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 51' ' ' PRO . . . . . 0.432 ' HD2' ' CD2' ' B' ' 50' ' ' HIS . 76.0 Cg_exo -42.55 -50.32 5.85 Favored 'Trans proline' 0 CA--C 1.533 0.439 0 C-N-CA 123.62 2.88 . . . . 11.35 114.143 -179.354 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -75.98 2.98 11.19 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.649 0.611 . . . . 9.28 112.649 -179.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -126.27 3.26 7.07 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.997 0.427 . . . . 7.52 110.841 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -67.6 -37.55 82.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.822 -0.626 . . . . 6.57 110.692 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 47.8 tp60 -65.86 -40.84 92.07 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.994 -0.743 . . . . 6.58 108.994 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.513 HD23 ' HB3' ' B' ' 76' ' ' PHE . 32.1 tp -57.2 -45.07 84.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.132 -0.94 . . . . 4.6 110.713 178.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.453 ' HA ' HD23 ' B' ' 57' ' ' LEU . 1.0 OUTLIER -61.02 -50.33 73.78 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.053 -0.521 . . . . 6.4 110.739 179.645 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 55.3 ttt180 -59.82 -45.39 92.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.783 -0.644 . . . . 8.18 110.925 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -62.0 -45.32 94.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.926 -0.579 . . . . 6.07 110.985 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 23.4 m -63.33 -37.85 88.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.219 -0.446 . . . . 5.59 110.684 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 61' ' ' PHE . . . . . 0.504 ' O ' HG12 ' B' ' 64' ' ' VAL . 4.3 m-30 -65.08 -41.0 95.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.379 -0.373 . . . . 7.73 110.411 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 87.4 mm-40 -63.9 -39.02 93.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.98 0.419 . . . . 6.89 110.273 179.184 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.438 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 39.2 mt-30 -69.11 -40.48 78.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.976 -0.556 . . . . 9.4 111.792 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.504 HG12 ' O ' ' B' ' 61' ' ' PHE . 4.0 p -67.19 -25.39 33.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-O 120.767 0.317 . . . . 7.57 111.11 -179.278 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 65' ' ' VAL . . . . . 0.508 ' HA ' HG21 ' B' ' 94' ' ' THR . 51.7 t -69.21 -35.83 69.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 109.263 -0.643 . . . . 7.43 109.263 178.594 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -70.48 -36.06 73.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.511 -0.768 . . . . 10.21 110.093 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' B' ' 63' ' ' GLN . 69.8 mt -65.56 -43.86 88.52 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.119 -0.697 . . . . 7.2 109.119 178.654 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 65.9 tttt 47.29 90.57 0.02 OUTLIER 'General case' 0 C--O 1.235 0.298 0 CA-C-N 114.801 -1.09 . . . . 7.58 112.837 178.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 108.6 1.59 32.67 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.552 -0.832 . . . . 5.57 112.334 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -114.94 165.34 12.97 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.986 -0.376 . . . . 5.43 109.986 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 6.6 t -108.14 127.13 64.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.067 0.461 . . . . 5.65 111.118 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 42.0 tp -119.52 103.11 9.14 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.567 -0.742 . . . . 4.51 109.062 178.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 73' ' ' SER . . . . . 0.575 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.3 p -86.64 112.59 21.76 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.046 -0.525 . . . . 6.35 111.228 -179.412 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 p -107.04 127.16 62.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.704 -0.68 . . . . 4.34 109.927 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 28.7 ttt -100.54 110.33 22.49 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.08 0.467 . . . . 5.42 110.815 -179.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.513 ' HB3' HD23 ' B' ' 56' ' ' LEU . 51.9 p90 -137.14 -173.16 3.38 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.729 -0.669 . . . . 3.54 109.368 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 77' ' ' ARG . . . . . 0.483 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 50.6 mtm180 -105.15 119.48 39.16 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.148 0.499 . . . . 6.8 110.507 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.464 ' HD2' HG11 ' B' ' 33' ' ' VAL . 16.8 t80 -102.49 148.84 25.03 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.2 -0.909 . . . . 5.79 110.339 -179.184 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 79' ' ' ARG . . . . . 0.649 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 3.6 ttp180 -90.06 124.27 34.64 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.205 -0.452 . . . . 11.08 110.185 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 80' ' ' SER . . . . . 0.499 ' HB3' HD21 ' B' ' 86' ' ' LEU . 95.0 p -91.52 -175.23 4.14 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.579 -0.526 . . . . 7.47 109.579 178.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -65.16 -16.6 63.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.113 0.482 . . . . 12.24 110.479 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -89.23 -0.22 57.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.13 -0.486 . . . . 9.25 110.458 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 69.16 12.59 8.53 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.7 -0.682 . . . . 8.3 111.678 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -89.96 154.85 19.53 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.937 -0.394 . . . . 6.78 109.937 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 85' ' ' TRP . . . . . 0.649 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 57.2 m95 -97.86 108.48 21.2 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.31 -0.405 . . . . 7.89 111.371 -178.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.499 HD21 ' HB3' ' B' ' 80' ' ' SER . 1.9 pp -109.31 147.52 32.54 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.071 -0.513 . . . . 6.97 110.176 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 87' ' ' TRP . . . . . 0.764 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 87.3 m95 -77.74 118.66 20.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.106 0.479 . . . . 8.55 110.231 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 7.3 tpp -123.32 135.07 54.02 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.589 -0.732 . . . . 4.46 111.319 -178.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 37.5 ttp180 -96.17 89.55 5.18 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.633 -0.877 . . . . 6.87 108.633 178.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 90' ' ' THR . . . . . 0.687 HG23 ' HB3' ' B' ' 108' ' ' CYS . 27.4 m -78.29 104.01 8.6 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.867 -0.606 . . . . 6.18 111.111 -179.304 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 91' ' ' SER . . . . . 0.588 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 1.8 m -85.63 91.0 8.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.875 -0.602 . . . . 6.3 109.707 179.57 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 9.3 m -78.53 122.22 25.6 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.814 -0.63 . . . . 6.65 111.58 -178.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -122.09 121.74 37.64 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.095 -0.502 . . . . 6.45 110.082 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 94' ' ' THR . . . . . 0.508 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.1 OUTLIER -82.23 110.25 17.25 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.449 -0.341 . . . . 9.17 110.395 179.483 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.68 126.51 30.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.138 0.494 . . . . 8.33 110.552 -179.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -96.26 119.05 34.03 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.555 -0.748 . . . . 10.53 110.446 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 97' ' ' ASN . . . . . 0.418 ' HB3' ' OE1' ' B' ' 102' ' ' GLU . 52.3 t30 -68.44 126.04 92.29 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.184 -0.673 . . . . 8.43 109.184 178.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.48 4.5 2.46 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 123.095 2.53 . . . . 9.16 114.084 -178.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -86.34 -70.56 0.6 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.843 0.354 . . . . 11.34 111.483 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -129.85 27.07 5.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.604 -0.271 . . . . 7.75 111.039 -179.496 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 33.8 t70 60.36 49.29 7.09 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.585 0.707 . . . . 9.08 110.215 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 102' ' ' GLU . . . . . 0.418 ' OE1' ' HB3' ' B' ' 97' ' ' ASN . 3.3 mp0 -97.8 153.92 17.97 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.876 -0.602 . . . . 7.71 110.123 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 46.0 mt -95.84 96.17 5.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 109.506 -0.553 . . . . 8.04 109.506 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -68.02 -47.83 67.37 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.995 -0.548 . . . . 8.81 110.819 -179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 105' ' ' TYR . . . . . 0.44 ' HB2' ' O ' ' B' ' 16' ' ' HIS . 8.8 p90 -167.93 178.39 5.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.406 -0.361 . . . . 7.4 110.41 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 54.0 mt -120.44 115.96 48.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.89 -0.596 . . . . 6.78 110.093 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.562 HG12 ' HG2' ' B' ' 15' ' ' ARG . 19.7 mt -91.25 119.67 38.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 109.36 -0.608 . . . . 6.31 109.36 179.463 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 108' ' ' CYS . . . . . 0.687 ' HB3' HG23 ' B' ' 90' ' ' THR . 71.4 m -111.43 117.88 34.28 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.909 0.385 . . . . 5.31 111.812 -179.329 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 109' ' ' THR . . . . . 0.588 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 28.9 m -81.54 97.75 7.97 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.965 -1.124 . . . . 5.48 107.965 177.209 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 110' ' ' ASN . . . . . 0.66 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.5 m-20 -79.39 102.1 8.5 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.708 -0.678 . . . . 6.9 110.906 -178.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.04 113.25 26.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.261 -0.427 . . . . 8.61 110.61 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -68.89 132.42 46.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.82 0.343 . . . . 11.84 110.558 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 113' ' ' VAL . . . . . 0.414 HG12 ' HG3' ' B' ' 114' ' ' LYS . 52.7 t -111.8 -46.18 5.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.987 -0.552 . . . . 11.77 110.239 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 114' ' ' LYS . . . . . 0.764 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 59.4 mtpt . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.568 -0.729 . . . . 12.68 109.927 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 57.8 m . . . . . 0 N--CA 1.477 0.92 0 N-CA-C 109.903 -0.406 . . . . 15.6 109.903 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.534 ' HB2' ' CB ' ' A' ' 31' ' ' ALA . 49.8 mm-40 -74.9 128.61 84.87 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 110.032 -0.359 . . . . 15.08 110.032 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.31 170.99 18.91 Favored 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 122.545 2.163 . . . . 13.43 112.332 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.604 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.1 OUTLIER -84.15 50.83 1.93 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.031 -0.531 . . . . 11.09 111.13 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.514 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 3.6 tm-20 -153.61 137.88 16.59 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.591 -0.731 . . . . 10.59 109.036 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.877 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 26.9 p90 -153.22 142.96 21.99 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.091 0.472 . . . . 8.93 110.874 179.534 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 50.3 mm -82.02 120.57 33.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.795 -0.639 . . . . 8.66 111.083 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.773 ' HB3' ' HE1' ' A' ' 22' ' ' PHE . 1.6 m -103.2 94.24 5.42 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.907 -0.588 . . . . 6.11 110.551 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.604 ' HD3' ' HB3' ' A' ' 24' ' ' PHE . 10.5 mtp180 -85.73 97.25 10.04 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.411 -0.588 . . . . 9.09 109.411 179.502 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 30.9 p80 -127.66 154.28 45.47 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.682 -0.69 . . . . 9.79 110.251 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.6 p-10 -73.61 178.18 4.89 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.525 -0.307 . . . . 12.69 110.427 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.6 pt -56.63 -28.95 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 112.815 0.672 . . . . 13.58 112.815 -179.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -77.57 -17.2 58.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.892 0.377 . . . . 13.85 111.399 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 105.79 -3.22 38.9 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.596 -0.811 . . . . 9.38 112.687 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.501 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 18.2 mm -71.62 117.15 14.51 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-O 120.764 0.316 . . . . 10.74 110.687 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.773 ' HE1' ' HB3' ' A' ' 14' ' ' SER . 98.6 m-85 -69.89 125.33 26.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.131 -0.486 . . . . 9.73 110.324 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 m -109.42 -21.55 12.45 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.358 0.599 . . . . 7.74 109.96 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.604 ' HB3' ' HD3' ' A' ' 15' ' ' ARG . 23.7 t80 -151.86 116.43 5.09 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.882 -0.784 . . . . 6.92 108.882 178.544 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.629 HG21 ' HB2' ' A' ' 40' ' ' LEU . 3.0 t -109.94 153.1 11.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-O 120.854 0.359 . . . . 6.02 110.917 -178.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.877 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 5.0 t70 -72.0 172.54 9.84 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.91 -0.587 . . . . 7.31 110.358 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -96.83 -25.01 15.62 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.319 0.58 . . . . 11.67 109.817 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 54.3 mtm180 -76.11 -4.34 40.99 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.485 -0.779 . . . . 11.91 112.371 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.9 p -59.25 -27.71 66.05 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 120.843 0.354 . . . . 12.99 111.544 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.432 ' O ' ' HA2' ' A' ' 34' ' ' GLY . 24.4 t -62.57 -34.94 67.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.98 -0.555 . . . . 16.15 110.923 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.534 ' CB ' ' HB2' ' A' ' 8' ' ' GLN . . . -93.48 -6.28 47.25 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.875 0.369 . . . . 15.07 111.011 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.8 m -90.99 -55.55 3.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.996 0.427 . . . . 14.9 110.304 179.131 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.541 HG11 ' HD2' ' A' ' 78' ' ' PHE . 3.7 m -123.56 -21.25 3.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.905 -0.589 . . . . 13.84 111.42 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.432 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 101.73 -17.49 54.71 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.391 -0.909 . . . . 13.85 112.147 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.466 ' H ' HG23 ' A' ' 33' ' ' VAL . 7.3 m-85 -71.41 137.2 48.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.806 0.336 . . . . 18.28 110.554 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -79.25 152.23 76.08 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.197 -0.668 . . . . 15.48 109.197 179.026 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.519 ' HB3' ' HB ' ' A' ' 25' ' ' VAL . 50.8 Cg_exo -53.89 -38.65 86.06 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.454 2.103 . . . . 11.63 112.168 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.42 ' HA ' HD12 ' A' ' 41' ' ' LEU . 26.2 mp0 -68.48 -16.61 63.95 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.833 -0.621 . . . . 13.31 111.624 -179.386 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.17 -23.48 35.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.991 0.424 . . . . 17.34 109.909 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.629 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.6 mm? -92.67 -32.24 14.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.874 -0.603 . . . . 13.25 110.288 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 86.8 mt -54.92 119.15 4.98 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.091 -0.504 . . . . 12.99 111.496 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.47 4.97 85.35 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.855 -0.688 . . . . 13.39 112.984 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.636 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 7.7 mmpt? -114.78 157.93 22.57 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 122.556 -0.379 . . . . 16.87 110.556 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.696 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 16.1 m120 -92.4 134.19 35.17 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.672 -0.492 . . . . 12.5 109.672 179.454 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.48 HD13 ' HZ ' ' A' ' 61' ' ' PHE . 11.3 tt -56.63 -30.39 31.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.991 0.424 . . . . 11.72 111.452 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.8 p -70.53 -17.94 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-N 116.247 -0.433 . . . . 12.89 111.753 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.696 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.2 mt-10 -72.48 -34.21 67.53 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.958 0.408 . . . . 16.53 110.431 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.456 ' HE1' ' HB3' ' A' ' 43' ' ' LYS . 68.3 m-85 -99.87 21.16 13.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.807 -0.633 . . . . 15.34 110.299 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 13.2 t -108.06 150.49 27.09 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.781 -0.645 . . . . 11.97 110.733 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.532 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 0.8 OUTLIER -56.09 128.17 71.23 Favored Pre-proline 0 C--N 1.333 -0.139 0 N-CA-C 109.019 -0.734 . . . . 14.67 109.019 178.612 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo -50.37 -40.91 52.82 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 122.777 2.318 . . . . 15.15 112.828 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -75.51 -14.55 60.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.484 -0.326 . . . . 16.47 111.36 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.532 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 34.5 m-20 -103.39 -6.63 21.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.605 -0.27 . . . . 13.16 111.203 -179.507 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -56.59 -42.56 78.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 15.83 111.344 -179.251 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 49.0 tp60 -64.68 -45.28 87.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.43 -0.35 . . . . 13.94 110.425 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.9 tp -59.55 -42.44 92.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.998 -0.546 . . . . 12.11 110.505 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.494 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.5 OUTLIER -63.16 -54.5 36.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.081 -0.509 . . . . 9.71 110.617 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 56.4 ttt180 -58.53 -41.02 84.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.08 -0.509 . . . . 11.06 110.919 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.38 -43.33 96.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.958 -0.564 . . . . 9.71 110.579 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.6 m -70.19 -32.58 70.57 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.791 -0.64 . . . . 9.52 111.148 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.548 ' O ' HG12 ' A' ' 64' ' ' VAL . 8.3 m-85 -62.09 -50.39 72.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.948 0.404 . . . . 11.4 110.488 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -67.86 -30.77 70.23 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.707 -0.479 . . . . 10.04 109.707 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -63.17 -45.32 92.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.633 -0.712 . . . . 10.6 110.915 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.548 HG12 ' O ' ' A' ' 61' ' ' PHE . 1.9 p -67.2 -24.1 31.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-O 120.813 0.34 . . . . 10.62 110.576 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.467 ' O ' ' HG3' ' A' ' 68' ' ' LYS . 69.3 t -72.43 -38.93 61.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 108.963 -0.754 . . . . 12.41 108.963 178.37 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 42.1 mtpt -73.46 -30.36 63.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.377 -0.829 . . . . 16.25 109.766 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 22.0 mt -68.36 -57.45 5.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.558 -0.747 . . . . 12.66 110.33 179.031 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 65' ' ' VAL . 67.7 mttt 62.97 83.47 0.16 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.685 -0.689 . . . . 14.83 112.175 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.51 -47.72 1.0 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.579 -0.82 . . . . 9.8 113.127 178.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -71.6 136.22 47.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.944 0.402 . . . . 9.59 110.599 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.522 ' HB ' ' HZ ' ' B' ' 24' ' ' PHE . 4.1 p -80.44 123.94 37.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.611 -0.722 . . . . 8.1 110.229 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 25.2 tp -107.14 109.56 21.42 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.067 0.461 . . . . 7.8 110.569 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.428 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 1.3 m -89.56 109.04 20.02 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.796 -0.638 . . . . 7.59 110.923 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 p -103.8 129.71 55.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.403 -0.362 . . . . 7.84 110.082 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 26.2 ttt -104.28 115.08 29.76 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.096 0.474 . . . . 9.35 110.433 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.565 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 31.6 p90 -145.86 178.58 8.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.797 -0.638 . . . . 9.66 109.975 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.806 ' HB3' ' HB3' ' A' ' 85' ' ' TRP . 9.0 mtt180 -98.14 116.51 30.51 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.836 0.35 . . . . 13.1 110.472 179.256 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.565 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 19.4 t80 -100.95 147.29 26.33 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.107 -0.497 . . . . 9.28 109.897 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.424 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 37.9 ttp180 -81.91 132.59 35.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.858 0.361 . . . . 10.87 111.001 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.469 ' HA ' ' HB ' ' A' ' 33' ' ' VAL . 54.6 p -95.94 -176.69 3.78 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.078 -0.51 . . . . 10.77 110.108 179.142 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.5 tptt -69.64 -18.74 63.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.344 0.592 . . . . 12.66 109.614 178.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 -91.38 5.33 49.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.634 -0.712 . . . . 14.42 109.685 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 65.51 23.71 11.83 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.115 -0.948 . . . . 12.69 111.659 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -98.71 164.89 12.05 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.123 -0.695 . . . . 10.85 109.123 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.806 ' HB3' ' HB3' ' A' ' 77' ' ' ARG . 55.2 m95 -109.61 112.63 24.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.133 0.492 . . . . 11.2 111.29 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.485 HD21 HG12 ' A' ' 33' ' ' VAL . 1.3 pp -108.66 150.31 27.72 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.77 -0.65 . . . . 11.12 110.17 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -76.34 116.35 16.94 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.019 0.437 . . . . 10.28 110.487 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 18.2 tpp -116.86 129.05 55.83 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.75 -0.659 . . . . 9.32 110.718 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.3 ttp180 -100.66 77.4 1.89 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.471 -0.937 . . . . 10.66 108.471 178.521 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.412 HG23 ' HB3' ' A' ' 108' ' ' CYS . 61.2 m -69.54 108.37 3.78 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.353 -0.84 . . . . 9.37 113.033 -177.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.449 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 1.5 m -86.78 95.1 9.72 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.947 -0.76 . . . . 8.27 108.947 177.675 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.3 m -83.63 130.71 34.98 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.005 0.372 . . . . 8.65 112.005 -178.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -124.58 129.07 49.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.714 -0.675 . . . . 11.56 110.057 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.38 115.23 15.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.29 -0.414 . . . . 10.16 111.001 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -89.99 106.18 18.3 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.968 0.413 . . . . 12.25 110.314 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.616 ' HG2' HG12 ' A' ' 103' ' ' ILE . 16.6 mt-30 -114.8 156.93 23.98 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.776 -0.647 . . . . 14.24 110.689 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.433 ' HB2' ' OE2' ' A' ' 102' ' ' GLU . 92.1 m-20 -95.2 149.09 35.7 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 109.096 -0.705 . . . . 13.83 109.096 178.632 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -83.15 18.42 1.5 Allowed 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 122.581 2.187 . . . . 15.34 112.58 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -97.71 -66.57 0.89 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.369 -0.378 . . . . 16.89 110.903 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.4 m -126.01 20.28 7.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.459 -0.337 . . . . 14.89 110.522 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.7 t70 60.41 33.51 20.7 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.715 -0.675 . . . . 14.77 110.94 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.433 ' OE2' ' HB2' ' A' ' 97' ' ' ASN . 0.5 OUTLIER -78.05 136.9 38.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.936 -0.575 . . . . 12.95 110.154 -179.826 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.616 HG12 ' HG2' ' A' ' 96' ' ' GLN . 45.8 mt -94.0 114.19 30.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.84 -0.43 . . . . 11.11 109.84 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -77.32 -53.56 7.55 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.828 0.347 . . . . 11.65 110.78 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 15.4 p90 -158.17 -178.27 7.17 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.271 -0.422 . . . . 10.3 110.525 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 24.4 mt -113.34 116.16 51.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.96 -0.564 . . . . 10.29 110.072 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 59.3 mt -83.21 100.1 6.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.14 -0.482 . . . . 8.99 109.875 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.432 ' HB2' ' HB2' ' A' ' 14' ' ' SER . 51.8 m -94.68 114.71 26.67 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.243 -0.435 . . . . 9.83 111.33 -179.582 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.449 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 4.0 m -87.51 93.02 9.29 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.912 -0.773 . . . . 10.84 108.912 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.514 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 6.2 m-20 -78.3 99.23 6.22 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.849 -0.614 . . . . 11.26 112.019 -178.171 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.796 HG21 HH12 ' B' ' 28' ' ' ARG . 0.7 OUTLIER -107.22 117.74 34.87 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.883 -0.414 . . . . 11.22 109.883 178.306 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ASN . . . . . 0.604 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 8.5 t-20 -76.53 130.13 37.47 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.016 0.436 . . . . 12.78 110.975 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 28.9 t -104.77 -54.79 6.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 115.622 -0.717 . . . . 14.64 109.576 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 46.7 mtpt . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.141 -0.933 . . . . 16.02 110.006 -179.656 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 77.2 m . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 110.173 -0.306 . . . . 7.49 110.173 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -120.72 151.5 54.51 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 116.565 -0.289 . . . . 7.12 110.224 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -66.06 161.13 41.24 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.751 2.3 . . . . 6.18 112.664 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' THR . . . . . 0.475 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.3 OUTLIER -82.09 59.81 4.59 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.834 -0.621 . . . . 5.81 111.364 -179.499 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.525 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -156.38 153.28 28.69 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.811 -0.811 . . . . 5.85 108.811 179.184 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -158.83 158.54 33.68 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.137 0.494 . . . . 6.08 111.358 179.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.583 ' HB ' ' HB2' ' B' ' 26' ' ' ASP . 21.5 mm -93.35 117.05 35.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.541 -0.754 . . . . 5.57 110.09 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.672 ' HB3' ' HE2' ' B' ' 22' ' ' PHE . 0.6 OUTLIER -107.32 96.31 6.32 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.094 -0.503 . . . . 5.3 111.303 -179.084 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 15' ' ' ARG . . . . . 0.666 ' HD3' ' HB3' ' B' ' 24' ' ' PHE . 23.5 mtp85 -90.66 107.7 19.34 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.908 -0.775 . . . . 8.97 108.908 179.046 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 16' ' ' HIS . . . . . 0.468 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 31.3 p80 -136.98 165.55 25.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.63 -0.259 . . . . 8.31 111.45 -178.643 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -77.94 177.33 8.34 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 116.038 -0.528 . . . . 10.83 110.245 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 22.8 pt -58.11 -30.48 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 N-CA-C 112.917 0.71 . . . . 8.89 112.917 -178.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -78.63 -16.85 56.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.08 0.467 . . . . 11.92 111.495 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 108.16 -1.12 33.25 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.432 -0.89 . . . . 8.57 112.359 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' ILE . . . . . 0.508 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 33.1 mm -69.56 111.87 3.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 N-CA-C 109.805 -0.443 . . . . 10.87 109.805 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 22' ' ' PHE . . . . . 0.672 ' HE2' ' HB3' ' B' ' 14' ' ' SER . 57.1 m-85 -63.57 126.72 28.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.248 -0.433 . . . . 8.23 110.972 -179.467 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 1.4 m -100.64 -33.37 10.32 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.957 -0.565 . . . . 7.91 110.237 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' PHE . . . . . 0.666 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 32.3 t80 -156.62 127.33 6.72 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.693 -0.685 . . . . 7.89 109.437 179.561 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 15.0 t -115.02 138.3 45.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.434 -0.348 . . . . 6.1 110.672 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' ASP . . . . . 0.583 ' HB2' ' HB ' ' B' ' 13' ' ' ILE . 9.6 t70 -75.02 141.65 43.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.058 -0.519 . . . . 7.15 109.698 179.173 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 18.4 m170 -70.4 87.54 0.63 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.05 0.453 . . . . 8.97 110.185 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' ARG . . . . . 0.796 HH12 HG21 ' A' ' 111' ' ' THR . 12.5 mtm180 -169.53 -21.57 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.022 -0.99 . . . . 9.76 110.408 -179.377 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 29' ' ' CYS . . . . . 0.419 ' H ' ' H ' ' B' ' 28' ' ' ARG . 24.3 p -55.86 -30.53 61.65 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.601 0.593 . . . . 11.56 112.601 -178.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.4 ' O ' ' HA2' ' B' ' 34' ' ' GLY . 3.2 t -68.36 -21.84 26.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.138 0.494 . . . . 13.64 110.782 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -96.25 -19.49 19.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.151 -0.477 . . . . 12.9 110.039 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 2.5 m -85.61 -60.02 2.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.978 -0.555 . . . . 12.13 111.303 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 33' ' ' VAL . . . . . 0.523 HG11 ' HD2' ' B' ' 78' ' ' PHE . 3.5 m -116.58 -14.52 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.808 0.337 . . . . 13.87 111.586 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 34' ' ' GLY . . . . . 0.4 ' HA2' ' O ' ' B' ' 30' ' ' VAL . . . 91.82 -2.96 77.27 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.503 -0.856 . . . . 13.79 112.817 179.379 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 35' ' ' TYR . . . . . 0.443 ' H ' HG23 ' B' ' 33' ' ' VAL . 5.4 m-85 -82.32 137.8 34.7 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.716 0.293 . . . . 15.38 110.62 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 36' ' ' GLN . . . . . 0.827 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 77.5 mm-40 -73.21 146.75 87.27 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 116.092 -0.504 . . . . 13.78 109.769 179.114 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.566 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 51.1 Cg_exo -53.89 -39.76 83.28 Favored 'Trans proline' 0 CA--C 1.529 0.27 0 C-N-CA 122.38 2.053 . . . . 14.71 112.125 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -69.34 -14.52 62.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.849 -0.614 . . . . 17.54 111.864 -179.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.827 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 29.3 mt-10 -82.72 -21.07 34.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.94 0.4 . . . . 14.24 110.368 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.46 ' HB3' ' CG ' ' B' ' 22' ' ' PHE . 1.2 mm? -94.57 -28.5 15.37 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.802 -0.635 . . . . 14.03 110.016 179.201 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 87.1 mt -62.71 119.21 8.84 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.986 -0.552 . . . . 13.62 110.692 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 90.24 -2.98 81.97 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.911 -0.661 . . . . 11.62 112.097 -179.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.508 ' O ' ' HA ' ' B' ' 21' ' ' ILE . 1.5 mmpt? -109.14 161.66 15.0 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.681 0.277 . . . . 13.82 110.29 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 44' ' ' ASN . . . . . 0.788 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 15.4 m120 -96.63 135.24 38.81 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.484 -0.562 . . . . 10.16 109.484 179.626 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.1 tt -60.68 -22.65 26.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.224 0.535 . . . . 9.62 110.75 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 46' ' ' VAL . . . . . 0.4 HG12 ' HB3' ' B' ' 44' ' ' ASN . 9.9 p -74.59 -18.19 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 116.052 -0.522 . . . . 11.5 111.196 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 47' ' ' GLU . . . . . 0.788 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 36.5 mt-10 -73.85 -38.25 64.55 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.959 0.409 . . . . 11.89 110.877 -179.526 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 48' ' ' PHE . . . . . 0.506 ' HB2' ' CZ ' ' B' ' 78' ' ' PHE . 25.4 m-85 -96.34 18.28 14.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.018 -0.537 . . . . 13.6 110.575 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 51.9 t -103.11 149.56 24.49 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.071 -0.513 . . . . 10.81 110.647 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' HIS . . . . . 0.668 ' HB3' ' HB2' ' B' ' 53' ' ' ASP . 9.3 t-160 -57.19 127.63 76.7 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.663 -0.699 . . . . 11.49 109.17 178.46 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_exo -45.06 -50.8 8.37 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.083 2.522 . . . . 11.35 113.438 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 13.5 mp0 -75.08 4.15 7.26 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.447 0.536 . . . . 9.28 112.447 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 53' ' ' ASP . . . . . 0.668 ' HB2' ' HB3' ' B' ' 50' ' ' HIS . 6.0 m-20 -122.46 -0.22 9.3 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.108 0.48 . . . . 7.52 110.341 179.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -66.69 -38.37 86.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.802 -0.635 . . . . 6.57 110.794 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 48.1 tp60 -65.65 -45.21 83.84 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.682 -0.488 . . . . 6.58 109.682 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 40.7 tp -58.77 -42.49 89.07 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.482 -0.781 . . . . 4.6 110.573 179.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.517 ' HA ' HD23 ' B' ' 57' ' ' LEU . 1.1 mt -63.02 -54.55 36.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.032 -0.531 . . . . 6.4 110.777 179.61 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 42.2 ttt180 -58.36 -43.63 88.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 8.18 111.059 -179.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -60.14 -46.04 91.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.042 -0.526 . . . . 6.07 110.645 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 42.5 m -63.92 -39.02 93.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.069 -0.514 . . . . 5.59 110.726 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 61' ' ' PHE . . . . . 0.457 ' O ' HG12 ' B' ' 64' ' ' VAL . 9.7 m-85 -62.95 -44.13 96.91 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.829 0.347 . . . . 7.73 110.287 179.392 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -66.93 -35.0 79.0 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.309 -0.405 . . . . 6.89 110.375 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.407 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 27.2 mt-30 -69.92 -40.76 75.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.109 -0.496 . . . . 9.4 111.593 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.457 ' HA ' HD12 ' B' ' 67' ' ' LEU . 9.8 p -70.02 -25.96 28.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 120.917 0.389 . . . . 7.57 110.832 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 65' ' ' VAL . . . . . 0.625 ' HA ' HG21 ' B' ' 94' ' ' THR . 24.6 t -68.44 -32.81 56.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.389 0.614 . . . . 7.43 109.407 178.609 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -78.53 -11.49 59.96 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.475 -0.784 . . . . 10.21 110.85 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.624 ' HB3' ' HB2' ' B' ' 70' ' ' GLN . 96.8 mt -82.7 -55.7 4.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.128 -0.487 . . . . 7.2 109.996 179.58 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 79.8 mttt 66.18 111.22 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.492 -0.777 . . . . 7.58 111.702 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 69' ' ' GLY . . . . . 0.433 ' HA3' ' OE1' ' B' ' 96' ' ' GLN . . . 75.98 19.54 78.63 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.626 -0.797 . . . . 5.57 112.291 179.665 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 70' ' ' GLN . . . . . 0.624 ' HB2' ' HB3' ' B' ' 67' ' ' LEU . 26.6 mm-40 -128.45 163.66 24.42 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.665 -0.495 . . . . 5.43 109.665 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 71' ' ' VAL . . . . . 0.443 ' HB ' ' HD1' ' B' ' 93' ' ' PHE . 9.8 p -116.72 131.16 70.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 121.27 0.557 . . . . 5.65 111.068 -179.232 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 21.0 tp -118.46 116.02 25.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.932 -0.577 . . . . 4.51 109.616 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 73' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.8 m -92.31 114.77 27.41 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.836 -0.62 . . . . 6.35 111.351 -179.072 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 74' ' ' VAL . . . . . 0.437 HG13 ' HB ' ' B' ' 90' ' ' THR . 2.5 p -108.04 128.8 63.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.931 -0.577 . . . . 4.34 110.0 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 27.9 ttt -102.16 108.08 19.37 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.032 0.444 . . . . 5.42 110.525 -179.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.426 ' HE2' ' HD1' ' B' ' 78' ' ' PHE . 26.8 p90 -138.49 -171.45 3.06 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.895 -0.593 . . . . 3.54 109.893 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 77' ' ' ARG . . . . . 0.615 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 59.0 mtm180 -114.66 119.29 36.23 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.15 0.5 . . . . 6.8 110.53 179.27 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.523 ' HD2' HG11 ' B' ' 33' ' ' VAL . 19.7 t80 -99.53 144.85 28.15 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.451 -0.795 . . . . 5.79 110.504 -179.055 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 79' ' ' ARG . . . . . . . . . . . . . 39.7 ttp180 -82.62 120.02 25.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.365 -0.38 . . . . 11.08 110.208 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 80' ' ' SER . . . . . 0.486 ' OG ' ' HG2' ' B' ' 84' ' ' GLU . 99.8 p -87.71 -175.21 5.09 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.841 0.353 . . . . 7.47 110.747 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 39.8 tptt -66.37 -16.72 64.29 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.023 -0.535 . . . . 12.24 110.418 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 23.7 m-20 -92.84 4.18 54.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.02 -0.536 . . . . 9.25 109.837 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 68.86 16.36 8.85 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.323 -0.853 . . . . 8.3 112.029 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 84' ' ' GLU . . . . . 0.486 ' HG2' ' OG ' ' B' ' 80' ' ' SER . 13.4 pt-20 -97.01 148.08 23.35 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.683 -0.488 . . . . 6.78 109.683 179.427 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 85' ' ' TRP . . . . . 0.615 ' HB3' ' HB3' ' B' ' 77' ' ' ARG . 2.7 m95 -95.05 103.63 15.49 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.089 -0.337 . . . . 7.89 110.089 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.509 HD21 HG12 ' B' ' 33' ' ' VAL . 1.6 pp -97.45 146.43 25.22 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.515 -0.311 . . . . 6.97 110.645 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 87' ' ' TRP . . . . . 0.59 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 87.0 m95 -72.8 116.97 13.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.392 -0.367 . . . . 8.55 110.111 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 88' ' ' MET . . . . . 0.416 ' SD ' ' HB3' ' B' ' 110' ' ' ASN . 3.9 ttp -131.3 134.57 46.49 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.01 -0.541 . . . . 4.46 110.657 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 37.5 ttp180 -96.98 105.28 17.4 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.72 -0.673 . . . . 6.87 109.353 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 90' ' ' THR . . . . . 0.776 HG23 ' HB3' ' B' ' 108' ' ' CYS . 19.7 m -88.32 106.89 18.53 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.895 -0.593 . . . . 6.18 111.014 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 91' ' ' SER . . . . . 0.454 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 0.8 OUTLIER -87.9 88.58 7.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.827 -0.624 . . . . 6.3 109.321 179.129 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 9.3 m -80.49 122.65 27.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.082 -0.508 . . . . 6.65 111.968 -178.251 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 93' ' ' PHE . . . . . 0.443 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 77.6 t80 -115.47 125.46 53.11 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.261 -0.427 . . . . 6.45 109.949 178.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 94' ' ' THR . . . . . 0.625 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.4 OUTLIER -88.33 104.3 16.63 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.757 0.313 . . . . 9.17 110.735 179.763 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -71.7 132.45 44.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.307 -0.406 . . . . 8.33 110.541 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 96' ' ' GLN . . . . . 0.433 ' OE1' ' HA3' ' B' ' 69' ' ' GLY . 50.9 mt-30 -99.0 137.65 37.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.851 -0.613 . . . . 10.53 111.851 -178.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 97' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -89.85 124.13 64.51 Favored Pre-proline 0 C--N 1.323 -0.568 0 N-CA-C 108.329 -0.989 . . . . 8.43 108.329 177.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.54 51.19 1.11 Allowed 'Trans proline' 0 CA--C 1.534 0.479 0 C-N-CA 123.137 2.558 . . . . 9.16 113.703 -179.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -138.02 -77.82 0.37 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.547 -0.297 . . . . 11.34 110.425 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 14.7 m -113.24 20.11 16.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.128 0.49 . . . . 7.75 109.908 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.6 t0 61.66 35.03 17.27 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.087 -0.961 . . . . 9.08 111.341 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -82.07 164.93 21.04 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.967 -0.561 . . . . 7.71 109.767 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 69.4 mt -103.33 118.77 50.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.486 -0.324 . . . . 8.04 110.284 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -66.09 -64.26 0.9 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.063 0.458 . . . . 8.81 109.788 179.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 6.6 p90 -157.92 172.47 18.4 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.392 -0.822 . . . . 7.4 109.666 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 57.8 mt -102.96 113.16 38.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.403 -0.362 . . . . 6.78 110.081 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 13.2 mt -88.91 105.52 15.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 109.332 -0.618 . . . . 6.31 109.332 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 108' ' ' CYS . . . . . 0.776 ' HB3' HG23 ' B' ' 90' ' ' THR . 97.1 m -99.25 106.1 18.19 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.375 0.509 . . . . 5.31 112.375 -178.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 109' ' ' THR . . . . . 0.454 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 2.9 m -79.89 84.26 5.69 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.647 -0.872 . . . . 5.48 108.647 177.51 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 110' ' ' ASN . . . . . 0.416 ' HB3' ' SD ' ' B' ' 88' ' ' MET . 7.3 m-20 -71.16 121.71 18.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.552 -0.749 . . . . 6.9 111.752 -178.286 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.13 116.63 22.36 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.213 -0.448 . . . . 8.61 110.111 179.045 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 112' ' ' ASN . . . . . 0.475 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 8.1 t-20 -68.44 135.3 51.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.116 0.484 . . . . 11.84 110.875 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 2.0 t -109.12 -50.12 7.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.683 -0.69 . . . . 11.77 109.9 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 114' ' ' LYS . . . . . 0.59 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 92.0 mttt . . . . . 0 C--O 1.246 0.905 0 CA-C-O 118.61 -0.71 . . . . 12.68 109.829 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.2 m . . . . . 0 N--CA 1.476 0.871 0 N-CA-C 110.45 -0.204 . . . . 15.6 110.45 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.428 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 74.1 mm-40 -87.52 111.52 42.21 Favored Pre-proline 0 C--N 1.326 -0.456 0 N-CA-C 109.794 -0.447 . . . . 15.08 109.794 178.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 8' ' ' GLN . 13.1 Cg_exo -69.57 159.9 51.79 Favored 'Trans proline' 0 C--O 1.233 0.271 0 C-N-CA 122.805 2.337 . . . . 13.43 112.664 -179.612 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.506 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.0 OUTLIER -86.87 55.77 3.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.853 -0.612 . . . . 11.09 110.233 179.79 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.479 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 8.8 tt0 -157.55 144.06 17.9 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.492 -0.776 . . . . 10.59 109.728 -178.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.818 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 27.2 p90 -150.63 143.58 24.69 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.066 0.46 . . . . 8.93 111.114 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.471 HG23 HG23 ' A' ' 107' ' ' ILE . 50.5 mm -80.0 115.23 22.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.902 -0.59 . . . . 8.66 110.444 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.917 ' HB3' ' HE2' ' A' ' 22' ' ' PHE . 1.6 m -100.21 99.52 10.22 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.986 -0.552 . . . . 6.11 110.94 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.646 ' HD3' ' HB3' ' A' ' 24' ' ' PHE . 15.1 mtp180 -91.72 106.7 18.67 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.419 -0.586 . . . . 9.09 109.419 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.8 p80 -133.73 159.98 38.94 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.507 -0.315 . . . . 9.79 110.887 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -75.82 179.32 5.55 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.336 -0.393 . . . . 12.69 110.618 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.1 pt -53.93 -36.45 30.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 112.528 0.566 . . . . 13.58 112.528 -179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -68.82 -46.47 68.54 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.989 0.424 . . . . 13.85 111.039 -179.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 137.22 -8.46 3.79 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.609 -0.805 . . . . 9.38 111.724 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.463 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 33.5 mm -64.99 116.1 3.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 109.908 -0.405 . . . . 10.74 109.908 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.917 ' HE2' ' HB3' ' A' ' 14' ' ' SER . 89.7 m-85 -66.82 122.33 17.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.156 -0.474 . . . . 9.73 110.885 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.82 -32.59 13.89 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.678 -0.692 . . . . 7.74 109.735 179.379 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.646 ' HB3' ' HD3' ' A' ' 15' ' ' ARG . 55.1 t80 -147.43 133.63 19.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.517 -0.765 . . . . 6.92 109.337 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.506 HG21 ' HB2' ' A' ' 40' ' ' LEU . 22.1 t -119.41 147.19 23.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.253 0.549 . . . . 6.02 111.606 -178.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.818 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 5.4 t70 -68.8 -179.55 1.47 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 114.911 -1.04 . . . . 7.31 110.499 179.27 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 25.8 m170 -108.34 -20.29 13.18 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.105 0.479 . . . . 11.67 110.226 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 63.9 mtm180 -76.94 -6.68 53.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.83 -0.623 . . . . 11.91 111.272 -179.514 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 25.1 p -57.65 -31.23 66.09 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.344 -0.389 . . . . 12.99 111.376 -179.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.491 ' O ' ' HA2' ' A' ' 34' ' ' GLY . 13.4 t -62.84 -31.43 52.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.943 -0.571 . . . . 16.15 111.057 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -92.77 -17.54 24.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.966 0.412 . . . . 15.07 110.781 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.443 ' HA ' HG22 ' A' ' 10' ' ' THR . 5.3 m -82.11 -67.33 0.79 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.067 -0.515 . . . . 14.9 110.927 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 2.4 m -113.11 -8.79 12.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.381 -0.372 . . . . 13.84 111.51 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.491 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 85.56 -2.64 87.9 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.519 -0.848 . . . . 13.85 112.234 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -78.16 136.7 37.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.858 0.361 . . . . 18.28 110.771 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.556 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 9.6 mm100 -77.98 149.31 76.65 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 108.708 -0.849 . . . . 15.48 108.708 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.432 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 76.4 Cg_exo -51.3 -38.19 61.63 Favored 'Trans proline' 0 CA--C 1.53 0.287 0 C-N-CA 122.555 2.17 . . . . 11.63 112.853 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.531 ' HA ' HD12 ' A' ' 41' ' ' LEU . 19.9 mp0 -71.67 -14.84 62.16 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.155 -0.475 . . . . 13.31 111.729 -179.075 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.556 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 31.5 mt-10 -81.18 -22.8 38.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.788 0.328 . . . . 17.34 110.295 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.506 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.9 mm? -94.68 -34.68 12.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.978 -0.555 . . . . 13.25 109.989 179.519 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.531 HD12 ' HA ' ' A' ' 38' ' ' GLN . 82.5 mt -57.88 120.89 9.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.808 -0.633 . . . . 12.99 111.068 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.15 3.3 87.52 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.66 -0.781 . . . . 13.39 112.471 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.758 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 8.7 mmpt? -112.64 163.25 14.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.86 0.362 . . . . 16.87 110.3 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.682 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 7.8 m120 -96.41 137.53 35.34 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.997 -0.547 . . . . 12.5 110.008 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 19.7 tt -63.47 -23.37 33.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.113 0.482 . . . . 11.72 111.075 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.44 HG12 ' HB3' ' A' ' 44' ' ' ASN . 8.3 p -78.73 -16.49 13.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.275 -0.42 . . . . 12.89 111.445 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.682 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.2 mt-10 -69.36 -39.83 77.86 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.019 0.437 . . . . 16.53 110.817 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.416 ' HB2' ' CZ ' ' A' ' 78' ' ' PHE . 22.8 m-85 -97.91 23.89 7.54 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.015 -0.539 . . . . 15.34 110.402 -179.43 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 52.4 t -104.94 147.18 28.06 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 115.847 -0.615 . . . . 11.97 110.066 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.461 ' CD2' ' HD2' ' A' ' 51' ' ' PRO . 8.4 t-160 -58.98 127.38 83.48 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.128 -0.487 . . . . 14.67 109.734 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.461 ' HD2' ' CD2' ' A' ' 50' ' ' HIS . 88.9 Cg_exo -43.6 -50.73 6.74 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.308 2.672 . . . . 15.15 113.77 -179.271 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.49 -3.27 17.02 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.48 0.548 . . . . 16.47 112.48 -179.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -120.58 1.83 10.64 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 122.195 -0.315 . . . . 13.16 110.901 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -62.85 -47.45 83.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.175 -0.466 . . . . 15.83 111.406 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 44.8 tp60 -69.38 -34.71 74.94 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.57 -0.53 . . . . 13.94 109.57 178.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.7 tp -57.76 -40.87 80.78 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.34 0.59 . . . . 12.11 109.81 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.407 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.7 OUTLIER -66.81 -46.06 76.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.468 -0.787 . . . . 9.71 110.02 179.052 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 69.1 ttt180 -61.45 -43.67 98.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.143 -0.481 . . . . 11.06 110.775 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -58.91 -39.13 80.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.214 0.53 . . . . 9.71 110.288 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.3 m -72.36 -33.9 67.61 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.679 -0.691 . . . . 9.52 110.618 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.523 ' O ' HG12 ' A' ' 64' ' ' VAL . 4.6 m-85 -64.29 -45.99 85.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.887 0.375 . . . . 11.4 110.207 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 73.1 mm-40 -64.15 -33.06 74.92 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.991 0.424 . . . . 10.04 109.928 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -64.77 -48.87 72.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.777 -0.647 . . . . 10.6 110.724 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.603 ' HA ' HD12 ' A' ' 67' ' ' LEU . 4.2 p -65.17 -26.93 40.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 CA-C-N 116.646 -0.252 . . . . 10.62 111.268 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 61' ' ' PHE . 55.5 t -69.31 -37.28 75.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 121.299 0.571 . . . . 12.41 109.694 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 27.4 mtpt -78.99 -33.0 45.42 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.794 -0.639 . . . . 16.25 109.946 179.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.727 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 66.6 mt -60.0 -56.56 20.14 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.914 -0.584 . . . . 12.66 110.639 179.531 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 65.3 mttt 62.21 103.65 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 O-C-N 123.861 0.726 . . . . 14.83 112.163 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 83.69 19.81 61.03 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.369 -0.919 . . . . 9.8 112.132 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.727 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 59.1 tp60 -128.84 139.35 52.21 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.167 -0.679 . . . . 9.59 109.167 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.487 ' CG2' ' HB3' ' A' ' 91' ' ' SER . 2.6 p -97.25 117.4 41.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.129 0.49 . . . . 8.1 110.383 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 46.4 tp -106.33 117.08 33.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.907 -0.588 . . . . 7.8 110.488 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.531 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 9.1 m -93.79 106.93 18.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.054 -0.521 . . . . 7.59 110.97 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.2 p -99.67 132.02 45.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.186 -0.461 . . . . 7.84 110.19 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 23.6 ttt -102.86 119.45 38.86 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.344 -0.389 . . . . 9.35 110.344 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.501 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 46.8 p90 -150.32 -174.67 4.81 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.787 -0.642 . . . . 9.66 109.385 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.464 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 36.1 mtm180 -107.38 121.79 45.29 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.153 0.501 . . . . 13.1 110.954 179.412 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.501 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 13.0 t80 -104.12 148.46 26.24 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.352 -0.84 . . . . 9.28 109.728 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.616 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 1.1 ttt180 -88.09 123.67 33.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.9 0.381 . . . . 10.87 110.735 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.557 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 85.2 p -85.38 -176.5 6.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.018 -0.537 . . . . 10.77 109.908 179.035 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.436 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 35.4 tptt -67.97 -17.3 64.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.321 0.581 . . . . 12.66 109.755 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -88.34 2.92 51.51 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.581 -0.736 . . . . 14.42 110.247 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 67.23 19.32 10.3 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 115.596 -0.729 . . . . 12.69 110.842 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.557 ' HG2' ' OG ' ' A' ' 80' ' ' SER . 5.8 pt-20 -94.59 154.37 17.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.087 -0.506 . . . . 10.85 109.902 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.616 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 44.7 m95 -101.36 105.77 16.86 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.422 -0.354 . . . . 11.2 110.61 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.464 ' O ' ' HA ' ' A' ' 77' ' ' ARG . 1.5 pp -107.92 151.63 25.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.23 -0.441 . . . . 11.12 110.385 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.571 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 89.8 m95 -78.43 120.88 23.79 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.073 0.463 . . . . 10.28 110.7 -179.247 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 5.9 tpp -122.96 140.2 53.27 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.748 -0.66 . . . . 9.32 111.071 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -102.44 94.37 5.65 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.343 -0.984 . . . . 10.66 108.343 177.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.584 HG23 ' HB3' ' A' ' 108' ' ' CYS . 45.4 m -86.92 105.21 16.93 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.893 -0.594 . . . . 9.37 112.048 -178.591 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.811 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 70.8 m -88.29 92.34 9.13 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.981 -0.554 . . . . 8.27 109.629 178.341 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' A' ' 108' ' ' CYS . 14.5 m -81.08 124.03 28.87 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.809 -0.632 . . . . 8.65 111.03 -178.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -121.57 120.16 34.02 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.815 -0.63 . . . . 11.56 109.488 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.09 115.11 10.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.875 0.369 . . . . 10.16 111.199 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -92.34 109.47 20.85 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.236 -0.438 . . . . 12.25 109.97 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.405 ' HA ' ' HA ' ' A' ' 103' ' ' ILE . 38.3 mt-30 -104.68 152.09 22.92 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.818 -0.628 . . . . 14.24 111.316 -179.26 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -91.75 137.95 25.26 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.67 -0.695 . . . . 13.83 109.425 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -73.6 36.59 0.39 Allowed 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 122.695 2.263 . . . . 15.34 113.451 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -109.77 -68.61 0.91 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.786 0.327 . . . . 16.89 110.545 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.64 20.68 8.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.335 -0.393 . . . . 14.89 110.806 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 24.2 t70 67.8 23.61 8.46 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.55 0.691 . . . . 14.77 110.406 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -82.87 142.98 31.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.055 -0.52 . . . . 12.95 111.217 -178.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.405 ' HA ' ' HA ' ' A' ' 96' ' ' GLN . 43.9 mt -87.27 113.5 24.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.191 -0.458 . . . . 11.11 110.274 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.409 ' H ' ' HG2' ' A' ' 104' ' ' GLU . 4.6 pt-20 -77.46 -41.76 38.45 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 121.069 -0.252 . . . . 11.65 110.415 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 29.4 p90 -163.82 175.15 10.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.697 0.285 . . . . 10.3 110.353 178.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 60.2 mt -118.4 121.88 68.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 116.283 -0.417 . . . . 10.29 110.449 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.493 HG12 ' HG2' ' A' ' 15' ' ' ARG . 42.1 mt -90.26 107.65 18.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.704 -0.48 . . . . 8.99 109.704 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.584 ' HB3' HG23 ' A' ' 90' ' ' THR . 72.8 m -98.96 112.7 24.74 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.186 0.517 . . . . 9.83 111.017 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.811 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 7.7 m -83.02 90.87 7.07 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.769 -0.826 . . . . 10.84 108.769 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.479 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 6.3 m-20 -79.29 94.63 5.5 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.825 -0.625 . . . . 11.26 111.67 -178.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 6.5 m -104.05 113.77 27.54 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.835 -0.431 . . . . 11.22 109.835 178.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ASN . . . . . 0.506 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 5.3 t30 -68.46 135.19 51.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.151 0.501 . . . . 12.78 111.097 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.416 HG12 ' HG3' ' A' ' 114' ' ' LYS . 40.7 t -109.3 -51.62 6.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.667 -0.697 . . . . 14.64 109.999 179.568 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.571 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 44.4 mtpt . . . . . 0 C--O 1.253 1.262 0 CA-C-O 118.276 -0.868 . . . . 16.02 109.917 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 22.0 m . . . . . 0 N--CA 1.478 0.946 0 CA-C-O 120.857 0.361 . . . . 7.49 110.074 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -138.65 163.54 46.13 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.349 -0.387 . . . . 7.12 110.77 -178.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.48 167.59 23.62 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.895 2.396 . . . . 6.18 112.023 179.256 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' THR . . . . . 0.611 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.0 OUTLIER -83.17 58.49 4.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.235 0.54 . . . . 5.81 111.145 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.669 ' HA ' ' O ' ' B' ' 110' ' ' ASN . 22.6 tt0 -162.09 129.05 3.79 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.496 -0.775 . . . . 5.85 109.443 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -138.55 154.69 48.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.199 0.523 . . . . 6.08 111.661 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.649 ' HB ' ' HB2' ' B' ' 26' ' ' ASP . 10.5 mm -88.35 120.43 37.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.54 -0.755 . . . . 5.57 110.664 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.71 ' HB3' ' HE2' ' B' ' 22' ' ' PHE . 0.7 OUTLIER -108.58 93.71 4.67 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.776 -0.647 . . . . 5.3 110.374 179.723 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 15' ' ' ARG . . . . . 0.625 ' HD3' ' HB3' ' B' ' 24' ' ' PHE . 11.2 mtp85 -85.72 108.65 18.15 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.375 -0.602 . . . . 8.97 109.375 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 16' ' ' HIS . . . . . 0.483 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 30.3 p80 -141.44 166.03 25.88 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.44 -0.345 . . . . 8.31 111.14 -179.152 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 12.0 p-10 -79.36 -177.76 5.9 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.235 -0.439 . . . . 10.83 110.469 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' ILE . . . . . 0.458 HG13 ' N ' ' B' ' 19' ' ' GLU . 9.8 pt -59.1 -35.02 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 112.459 0.54 . . . . 8.89 112.459 -178.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 19' ' ' GLU . . . . . 0.458 ' N ' HG13 ' B' ' 18' ' ' ILE . 18.2 mt-10 -71.87 -28.3 63.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.018 0.437 . . . . 11.92 111.29 -179.371 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 117.44 -1.91 18.43 Favored Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 120.428 -0.892 . . . . 8.57 113.168 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' ILE . . . . . 0.458 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 36.9 mm -66.29 111.17 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.03 -0.359 . . . . 10.87 110.03 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 22' ' ' PHE . . . . . 0.71 ' HE2' ' HB3' ' B' ' 14' ' ' SER . 95.5 m-85 -66.85 130.92 44.72 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.175 -0.466 . . . . 8.23 110.941 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 1.1 m -108.6 -27.55 9.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.923 -0.581 . . . . 7.91 110.64 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 24' ' ' PHE . . . . . 0.625 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 15.7 t80 -160.21 137.19 9.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.014 -0.539 . . . . 7.89 109.97 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 10.9 t -125.69 146.06 32.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.429 -0.35 . . . . 6.1 110.811 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' ASP . . . . . 0.649 ' HB2' ' HB ' ' B' ' 13' ' ' ILE . 5.8 t0 -71.16 161.89 30.35 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.463 -0.569 . . . . 7.15 109.463 179.036 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 2.9 m-70 -80.26 37.03 0.37 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.811 0.339 . . . . 8.97 111.251 -179.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 28' ' ' ARG . . . . . 0.508 ' HD2' ' O ' ' B' ' 11' ' ' GLU . 29.0 mtm180 -128.39 3.07 5.66 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.887 0.375 . . . . 9.76 111.114 -179.292 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 1.8 p -62.74 -46.77 86.51 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 112.413 0.523 . . . . 11.56 112.413 -178.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 6.7 t -67.54 -26.48 35.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 121.079 0.466 . . . . 13.64 111.038 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.87 -22.13 43.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.217 -0.447 . . . . 12.9 111.108 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 13.0 m -92.57 -59.7 2.01 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.29 0.478 . . . . 12.13 112.29 -178.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 33' ' ' VAL . . . . . 0.561 HG12 HD21 ' B' ' 86' ' ' LEU . 3.2 m -118.63 -5.53 11.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 112.195 0.442 . . . . 13.87 112.195 -178.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.3 20.34 64.76 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.536 -0.84 . . . . 13.79 112.21 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 35' ' ' TYR . . . . . 0.455 ' HD1' ' HA ' ' B' ' 35' ' ' TYR . 1.0 OUTLIER -93.0 130.72 38.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.675 0.274 . . . . 15.38 110.909 -179.726 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -75.0 144.86 80.13 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 109.111 -0.7 . . . . 13.78 109.111 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.442 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 52.2 Cg_exo -54.52 -32.99 76.42 Favored 'Trans proline' 0 CA--C 1.529 0.233 0 C-N-CA 122.459 2.106 . . . . 14.71 112.23 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 38' ' ' GLN . . . . . 0.566 ' HA ' HD12 ' B' ' 41' ' ' LEU . 26.9 mp0 -75.52 -17.11 60.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.615 -0.721 . . . . 17.54 111.971 -179.407 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -75.54 -40.26 57.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.96 0.409 . . . . 14.24 110.574 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.524 ' HB3' ' CG ' ' B' ' 22' ' ' PHE . 1.9 mm? -74.84 -26.02 59.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.836 -0.62 . . . . 14.03 111.201 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.566 HD12 ' HA ' ' B' ' 38' ' ' GLN . 75.3 mt -61.48 119.8 9.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 13.62 111.469 -179.095 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.6 11.72 79.32 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.834 -0.698 . . . . 11.62 113.055 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.591 ' HE2' ' HA ' ' B' ' 43' ' ' LYS . 8.6 mmpt? -121.88 158.58 28.67 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.754 0.311 . . . . 13.82 110.479 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 44' ' ' ASN . . . . . 0.56 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 12.4 m120 -94.16 139.94 30.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.055 -0.52 . . . . 10.16 109.84 179.44 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.6 tt -62.08 -24.48 34.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.996 0.427 . . . . 9.62 111.378 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 6.3 p -71.88 -18.29 19.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.172 -0.467 . . . . 11.5 111.217 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 47' ' ' GLU . . . . . 0.56 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 38.1 mt-10 -75.81 -23.15 55.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.995 0.426 . . . . 11.89 111.031 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -110.09 22.05 16.05 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.023 -0.535 . . . . 13.6 110.092 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 51.4 t -110.6 150.87 28.34 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.682 -0.69 . . . . 10.81 110.451 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -59.64 126.24 82.19 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.807 -0.633 . . . . 11.49 109.576 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 51' ' ' PRO . . . . . 0.407 ' HA ' ' OE1' ' B' ' 54' ' ' GLN . 81.9 Cg_exo -47.29 -42.21 27.55 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.058 2.505 . . . . 11.35 113.58 -179.332 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 9.1 mp0 -78.45 0.32 26.31 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 112.334 0.494 . . . . 9.28 112.334 -179.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -129.83 5.05 5.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.888 0.375 . . . . 7.52 110.933 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 54' ' ' GLN . . . . . 0.407 ' OE1' ' HA ' ' B' ' 51' ' ' PRO . 70.8 mt-30 -63.75 -43.46 96.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.104 -0.498 . . . . 6.57 110.719 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 49.6 tp60 -63.63 -39.63 94.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.956 -0.566 . . . . 6.58 109.535 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.78 -42.42 84.08 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.986 -0.552 . . . . 4.6 110.498 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.439 HD23 ' HA ' ' B' ' 57' ' ' LEU . 0.5 OUTLIER -63.72 -51.76 63.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 6.4 110.269 179.489 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 58' ' ' ARG . . . . . 0.404 ' O ' ' HG2' ' B' ' 62' ' ' GLN . 70.8 ttt180 -58.79 -44.29 90.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.82 -0.627 . . . . 8.18 110.878 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -59.25 -42.87 92.13 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.749 -0.66 . . . . 6.07 110.975 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 20.3 m -66.82 -34.02 76.9 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.867 -0.606 . . . . 5.59 110.592 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 61' ' ' PHE . . . . . 0.408 ' O ' HG12 ' B' ' 64' ' ' VAL . 9.5 m-85 -64.64 -37.87 89.05 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.104 0.478 . . . . 7.73 109.781 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 62' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' B' ' 58' ' ' ARG . 93.8 mm-40 -63.99 -44.45 92.62 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.805 -0.634 . . . . 6.89 110.524 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -68.08 -40.44 82.68 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.615 -0.721 . . . . 9.4 111.776 -179.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.412 HG21 ' O ' ' B' ' 92' ' ' SER . 9.5 p -68.17 -28.57 41.39 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 C-N-CA 120.861 -0.336 . . . . 7.57 110.512 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 65' ' ' VAL . . . . . 0.411 ' HA ' HG21 ' B' ' 94' ' ' THR . 20.3 t -71.46 -37.25 63.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.01 -0.737 . . . . 7.43 109.01 178.113 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 18.3 mtpt -68.82 -37.52 79.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.527 -0.761 . . . . 10.21 110.278 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 48.2 mt -62.02 -49.45 75.99 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.909 -0.587 . . . . 7.2 110.292 179.333 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 22.1 mttt 63.85 112.23 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 O-C-N 124.006 0.816 . . . . 7.58 112.46 179.133 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 77.18 23.07 69.46 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.851 -0.69 . . . . 5.57 112.72 178.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -129.8 166.16 20.48 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.818 0.342 . . . . 5.43 110.697 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 71' ' ' VAL . . . . . 0.642 ' HB ' ' HD1' ' B' ' 93' ' ' PHE . 2.8 p -116.19 120.34 64.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.874 -0.603 . . . . 5.65 110.874 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 46.3 tp -107.22 119.5 39.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.914 -0.584 . . . . 4.51 109.96 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 73' ' ' SER . . . . . 0.413 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 0.9 OUTLIER -89.38 111.73 22.66 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.97 -0.559 . . . . 6.35 110.781 -179.48 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.4 p -110.84 132.39 59.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.859 -0.423 . . . . 4.34 109.859 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 21.7 ttt -106.45 114.96 29.39 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.095 0.474 . . . . 5.42 110.972 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.546 ' HE2' ' HD1' ' B' ' 78' ' ' PHE . 49.6 p90 -144.96 -175.35 4.65 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.505 -0.771 . . . . 3.54 108.998 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 77' ' ' ARG . . . . . 0.464 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 40.4 mtm180 -106.7 118.47 36.75 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.048 0.451 . . . . 6.8 110.497 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.546 ' HD1' ' HE2' ' B' ' 76' ' ' PHE . 14.8 t80 -97.13 145.66 25.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.297 -0.865 . . . . 5.79 110.201 -179.374 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 79' ' ' ARG . . . . . 0.532 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 22.4 ttp180 -85.8 129.72 34.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.3 -0.409 . . . . 11.08 110.676 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 80' ' ' SER . . . . . 0.547 ' HA ' ' HB ' ' B' ' 33' ' ' VAL . 88.6 p -89.77 -177.83 5.35 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.704 -0.48 . . . . 7.47 109.704 178.628 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 51.6 tptt -68.47 -23.38 64.58 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.325 0.583 . . . . 12.24 109.547 178.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -86.13 4.66 37.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.631 -0.713 . . . . 9.25 110.349 178.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 67.07 29.23 8.04 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.45 -0.796 . . . . 8.3 111.469 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 84' ' ' GLU . . . . . 0.457 ' O ' ' HA ' ' B' ' 79' ' ' ARG . 1.7 pt-20 -95.88 152.91 18.07 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.153 -0.684 . . . . 6.78 109.153 178.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 85' ' ' TRP . . . . . 0.532 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 73.2 m95 -104.31 93.89 5.06 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.792 0.33 . . . . 7.89 110.384 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.561 HD21 HG12 ' B' ' 33' ' ' VAL . 1.8 pp -96.99 148.8 22.6 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.224 -0.444 . . . . 6.97 110.494 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 87' ' ' TRP . . . . . 0.497 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 90.5 m95 -72.82 121.99 20.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.965 0.412 . . . . 8.55 110.581 -179.635 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 27.2 tpp -122.47 131.62 53.95 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.782 -0.645 . . . . 4.46 110.981 -178.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 15.9 ttp180 -100.38 72.69 1.62 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.517 -0.92 . . . . 6.87 108.517 178.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 90' ' ' THR . . . . . 0.51 HG23 ' HB3' ' B' ' 108' ' ' CYS . 54.0 m -66.81 113.02 4.56 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.201 -0.908 . . . . 6.18 112.083 -178.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 91' ' ' SER . . . . . 0.413 ' HA ' ' HA ' ' B' ' 73' ' ' SER . 1.6 m -95.1 96.82 9.49 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.935 -0.765 . . . . 6.3 108.935 178.783 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 92' ' ' SER . . . . . 0.467 ' O ' ' HA ' ' B' ' 71' ' ' VAL . 16.3 m -84.06 117.39 23.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.274 -0.421 . . . . 6.65 111.819 -178.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 93' ' ' PHE . . . . . 0.642 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 71.2 t80 -110.08 122.12 46.84 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.086 -0.506 . . . . 6.45 110.161 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 94' ' ' THR . . . . . 0.411 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.7 OUTLIER -87.3 118.4 26.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.755 0.312 . . . . 9.17 111.01 179.796 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 95' ' ' PHE . . . . . 0.459 ' O ' ' HA ' ' B' ' 103' ' ' ILE . 0.0 OUTLIER -83.58 130.9 35.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.811 0.339 . . . . 8.33 110.919 -179.837 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -104.71 111.04 23.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.964 -0.562 . . . . 10.53 110.958 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 97' ' ' ASN . . . . . 0.478 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 65.3 t30 -74.32 127.3 87.93 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 109.513 -0.551 . . . . 8.43 109.513 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 98' ' ' PRO . . . . . 0.478 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 62.1 Cg_endo -74.71 20.02 0.45 Allowed 'Trans proline' 0 CA--C 1.535 0.554 0 C-N-CA 122.714 2.276 . . . . 9.16 113.884 -179.515 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -91.69 -56.72 3.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.938 0.399 . . . . 11.34 110.1 179.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 100' ' ' SER . . . . . 0.427 ' HB2' ' HG3' ' B' ' 102' ' ' GLU . 1.4 m -135.95 16.46 3.28 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.531 -0.544 . . . . 7.75 109.531 179.055 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 23.7 t70 63.84 40.26 7.68 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.232 -0.894 . . . . 9.08 110.497 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 102' ' ' GLU . . . . . 0.427 ' HG3' ' HB2' ' B' ' 100' ' ' SER . 0.0 OUTLIER -96.83 158.87 15.22 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.708 -0.678 . . . . 7.71 110.481 179.948 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 103' ' ' ILE . . . . . 0.459 ' HA ' ' O ' ' B' ' 95' ' ' PHE . 68.7 mt -95.44 105.05 16.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.709 -0.478 . . . . 8.04 109.709 179.082 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -60.59 -52.33 65.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.84 -0.618 . . . . 8.81 110.962 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -164.37 171.16 15.13 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.613 -0.721 . . . . 7.4 110.019 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 37.8 mt -108.47 119.54 58.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.952 -0.567 . . . . 6.78 109.951 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.408 ' HB ' ' HB3' ' B' ' 93' ' ' PHE . 33.5 mt -86.6 97.98 6.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 109.443 -0.577 . . . . 6.31 109.443 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 108' ' ' CYS . . . . . 0.51 ' HB3' HG23 ' B' ' 90' ' ' THR . 92.5 m -92.68 104.38 16.66 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.178 0.436 . . . . 5.31 112.178 -179.103 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 109' ' ' THR . . . . . 0.414 ' HA ' HD13 ' B' ' 13' ' ' ILE . 3.5 m -78.28 97.46 5.57 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.606 -0.887 . . . . 5.48 108.606 177.783 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 110' ' ' ASN . . . . . 0.669 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.2 m-20 -80.56 89.02 5.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.012 -0.54 . . . . 6.9 111.78 -178.118 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 3.3 m -94.78 112.55 24.28 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.199 -0.455 . . . . 8.61 110.496 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 112' ' ' ASN . . . . . 0.611 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 4.2 t-20 -70.49 131.66 44.37 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.068 0.461 . . . . 11.84 110.779 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 93.5 t -104.79 -55.94 5.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.591 -0.732 . . . . 11.77 109.986 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 114' ' ' LYS . . . . . 0.497 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 42.2 mtpt . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.197 -0.906 . . . . 12.68 109.937 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.9 m . . . . . 0 N--CA 1.477 0.895 0 N-CA-C 109.892 -0.41 . . . . 15.6 109.892 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -91.33 117.22 67.7 Favored Pre-proline 0 C--N 1.325 -0.479 0 N-CA-C 110.239 -0.282 . . . . 15.08 110.239 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.408 ' HG2' ' HD2' ' A' ' 28' ' ' ARG . 33.0 Cg_endo -65.75 154.32 74.38 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.572 2.181 . . . . 13.43 111.94 179.496 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.715 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.8 OUTLIER -77.35 43.25 0.37 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.229 0.538 . . . . 11.09 111.33 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.571 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 32.8 tt0 -145.75 126.48 14.33 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.852 -0.796 . . . . 10.59 108.852 -179.306 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.957 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 33.5 p90 -145.35 156.42 43.78 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.088 0.47 . . . . 8.93 111.342 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.567 HG23 HG23 ' A' ' 107' ' ' ILE . 21.8 mm -85.31 117.13 29.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.681 -0.69 . . . . 8.66 110.995 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.434 ' HB3' ' HE1' ' A' ' 22' ' ' PHE . 0.8 OUTLIER -105.75 92.5 4.2 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.119 -0.492 . . . . 6.11 110.294 179.481 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 15' ' ' ARG . 6.4 mtt180 -81.48 117.59 22.03 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.482 -0.562 . . . . 9.09 109.482 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.1 p80 -149.16 159.28 44.38 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.921 -0.311 . . . . 9.79 111.041 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.2 p-10 -80.76 178.06 8.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.308 -0.406 . . . . 12.69 110.349 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.9 pt -58.56 -28.07 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 113.087 0.773 . . . . 13.58 113.087 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -75.06 -23.65 58.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.28 0.562 . . . . 13.85 110.878 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 112.84 -7.27 25.74 Favored Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 120.841 -0.695 . . . . 9.38 111.748 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.461 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 38.9 mm -66.88 115.19 4.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 110.011 -0.366 . . . . 10.74 110.011 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.461 ' CZ ' ' HB ' ' A' ' 45' ' ' ILE . 98.0 m-85 -71.37 128.59 36.38 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.953 -0.567 . . . . 9.73 111.402 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 23.4 p -95.04 -31.59 13.52 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.25 -0.886 . . . . 7.74 110.102 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -155.47 132.16 10.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.465 -0.789 . . . . 6.92 109.423 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.656 HG21 ' HB2' ' A' ' 40' ' ' LEU . 21.6 t -116.99 143.38 27.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.722 0.296 . . . . 6.02 110.972 -179.22 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.957 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 6.9 t70 -67.23 166.03 14.98 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.76 -0.654 . . . . 7.31 110.396 179.239 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 51.5 m170 -87.82 -13.28 42.58 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.928 0.395 . . . . 11.67 110.648 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.488 HH22 HG21 ' B' ' 107' ' ' ILE . 79.2 mtm180 -81.73 -1.96 48.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.227 -0.442 . . . . 11.91 112.033 -179.239 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 29.2 p -65.04 -30.45 71.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.945 0.402 . . . . 12.99 111.257 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 24.7 t -61.47 -39.72 83.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.838 -0.619 . . . . 16.15 111.665 -179.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.73 -18.19 33.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.703 0.287 . . . . 15.07 111.426 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.3 m -85.09 -53.3 5.36 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.344 -0.389 . . . . 14.9 111.917 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.48 HG23 ' H ' ' A' ' 35' ' ' TYR . 3.7 m -123.5 -15.5 5.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.2 0.445 . . . . 13.84 112.2 -179.143 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 92.41 -13.82 66.28 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.439 -0.886 . . . . 13.85 111.833 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.48 ' H ' HG23 ' A' ' 33' ' ' VAL . 4.7 m-30 -71.46 133.04 45.6 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.679 -0.26 . . . . 18.28 110.58 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.497 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 14.7 mm100 -78.25 150.77 77.65 Favored Pre-proline 0 C--N 1.321 -0.668 0 N-CA-C 108.445 -0.946 . . . . 15.48 108.445 178.167 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.616 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 74.5 Cg_exo -50.22 -43.17 44.43 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.468 2.112 . . . . 11.63 112.515 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -63.49 -22.51 66.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.001 -0.545 . . . . 13.31 112.099 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.497 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 36.5 mt-10 -74.9 -22.54 58.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.852 0.358 . . . . 17.34 110.922 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.656 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.9 mm? -98.14 -30.07 12.86 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.124 -0.489 . . . . 13.25 110.792 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 92.3 mt -62.77 108.28 1.14 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 12.99 111.217 -179.166 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 97.04 2.86 59.21 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.894 -0.67 . . . . 13.39 112.153 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.785 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 4.1 mmpt? -112.4 158.26 20.04 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 110.331 -0.248 . . . . 16.87 110.331 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.818 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 15.4 m120 -94.01 135.86 34.91 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.973 -0.38 . . . . 12.5 109.973 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.461 ' HB ' ' CZ ' ' A' ' 22' ' ' PHE . 13.8 tt -63.79 -27.34 42.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.014 0.435 . . . . 11.72 110.501 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 6.1 p -68.5 -17.72 22.47 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 116.086 -0.507 . . . . 12.89 111.392 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.818 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 34.9 mt-10 -78.49 -35.04 47.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.939 0.4 . . . . 16.53 111.143 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.459 ' HE2' ' HB3' ' A' ' 43' ' ' LYS . 48.8 m-85 -95.46 6.44 48.97 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.183 0.516 . . . . 15.34 110.752 -179.443 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 48.9 t -93.75 154.66 17.65 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.807 -0.633 . . . . 11.97 110.343 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.527 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 3.7 t-160 -62.43 128.44 91.37 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.647 -0.706 . . . . 14.67 109.512 179.178 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -44.6 -50.47 8.18 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 123.195 2.597 . . . . 15.15 114.25 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -73.1 -11.56 60.59 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.794 0.294 . . . . 16.47 111.794 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.527 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 5.5 m-20 -107.29 -0.16 22.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.863 0.363 . . . . 13.16 110.881 -179.371 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -60.89 -50.21 74.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.046 -0.524 . . . . 15.83 111.17 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -64.38 -36.05 82.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.786 0.327 . . . . 13.94 110.24 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 29.7 tp -58.1 -45.41 87.27 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.2 0.524 . . . . 12.11 109.744 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.429 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.4 OUTLIER -68.12 -47.23 68.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.481 -0.781 . . . . 9.71 109.984 179.041 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 36.9 ttt180 -54.26 -47.22 72.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.213 -0.903 . . . . 11.06 111.279 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -64.61 -43.86 92.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.133 -0.485 . . . . 9.71 110.924 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.7 m -60.04 -35.28 74.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.342 -0.39 . . . . 9.52 110.645 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.543 ' O ' HG12 ' A' ' 64' ' ' VAL . 7.4 m-85 -65.28 -46.09 81.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.321 -0.4 . . . . 11.4 110.19 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -66.27 -34.97 79.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.195 0.522 . . . . 10.04 109.944 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -63.87 -40.67 97.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.667 -0.697 . . . . 10.6 110.61 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.543 HG12 ' O ' ' A' ' 61' ' ' PHE . 0.4 OUTLIER -70.02 -25.63 28.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 116.564 -0.289 . . . . 10.62 110.872 -179.731 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 61' ' ' PHE . 75.5 t -69.03 -37.79 77.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 109.026 -0.731 . . . . 12.41 109.026 178.301 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 48.5 mtpt -76.5 -28.52 56.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.252 -0.886 . . . . 16.25 110.242 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.641 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 58.3 mt -71.71 -56.74 5.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.466 . . . . 12.66 110.79 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.417 ' HG3' ' O ' ' A' ' 65' ' ' VAL . 78.7 mttt 62.47 104.96 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 O-C-N 123.727 0.642 . . . . 14.83 112.315 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.04 -4.03 86.58 Favored Glycine 0 N--CA 1.454 -0.16 0 C-N-CA 120.716 -0.754 . . . . 9.8 112.942 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.641 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 7.1 tp-100 -101.53 130.31 47.78 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.67 -0.493 . . . . 9.59 109.67 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 2.7 p -83.29 107.26 14.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.288 0.566 . . . . 8.1 110.251 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 20.1 tp -100.08 110.98 23.28 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.996 -0.547 . . . . 7.8 110.312 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.441 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 0.0 OUTLIER -89.23 108.6 19.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.998 -0.546 . . . . 7.59 111.096 -179.612 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.428 HG13 ' HB ' ' A' ' 90' ' ' THR . 2.3 p -100.36 125.35 54.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.13 -0.486 . . . . 7.84 109.758 178.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 23.0 ttt -100.52 106.87 18.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.341 -0.391 . . . . 9.35 110.349 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.503 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 46.0 p90 -134.25 -174.47 3.56 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.815 -0.63 . . . . 9.66 110.159 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.491 ' HB2' ' HB2' ' A' ' 50' ' ' HIS . 47.4 mtt180 -105.08 117.14 33.25 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.184 -0.462 . . . . 13.1 110.195 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.503 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 11.4 t80 -107.03 147.6 29.74 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.019 -0.537 . . . . 9.28 109.888 -179.526 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.535 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 35.2 ttp180 -87.9 136.47 32.95 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.852 0.358 . . . . 10.87 110.885 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.417 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 66.0 p -96.52 -174.39 3.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.103 -0.499 . . . . 10.77 109.999 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.446 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 42.1 tptt -70.65 -14.25 62.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.346 0.593 . . . . 12.66 109.841 178.819 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -92.6 3.1 56.2 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.782 -0.644 . . . . 14.42 109.624 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 67.4 20.7 9.88 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.4 -0.818 . . . . 12.69 111.172 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.417 ' HG2' ' OG ' ' A' ' 80' ' ' SER . 3.2 pt-20 -96.07 153.47 17.76 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.357 -0.608 . . . . 10.85 109.357 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.535 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 67.1 m95 -100.29 112.17 24.49 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.892 0.377 . . . . 11.2 110.676 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.446 HD13 HD22 ' A' ' 112' ' ' ASN . 1.5 pp -110.02 156.04 21.04 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.241 -0.436 . . . . 11.12 110.643 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.513 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 82.5 m95 -81.67 114.65 20.48 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.197 0.523 . . . . 10.28 110.786 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 38.1 tpp -114.92 131.54 56.84 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.435 -0.802 . . . . 9.32 110.886 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.6 ttp180 -101.52 76.84 1.71 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.838 -0.801 . . . . 10.66 108.838 178.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.72 HG23 ' HB3' ' A' ' 108' ' ' CYS . 36.7 m -67.33 109.58 3.2 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.381 -0.827 . . . . 9.37 112.066 -178.798 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.441 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 0.7 OUTLIER -90.25 88.8 7.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.265 -0.879 . . . . 8.27 109.442 179.506 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.1 m -74.07 131.27 41.17 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.95 -0.568 . . . . 8.65 111.897 -178.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -130.3 122.43 27.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.878 -0.601 . . . . 11.56 110.176 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.26 119.24 18.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.402 -0.363 . . . . 10.16 111.388 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -101.52 106.97 18.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.942 0.401 . . . . 12.25 109.997 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -104.01 152.02 22.53 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.086 -0.506 . . . . 14.24 111.335 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.439 ' HB3' ' OE1' ' A' ' 102' ' ' GLU . 11.4 t-20 -86.3 133.03 41.4 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 108.79 -0.818 . . . . 13.83 108.79 178.553 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.62 14.4 0.41 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 122.81 2.34 . . . . 15.34 113.898 -178.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -87.29 -54.72 4.15 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.883 0.373 . . . . 16.89 110.294 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 18.8 m -142.38 19.91 2.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.142 -0.481 . . . . 14.89 110.179 178.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 18.4 t70 67.93 32.15 5.28 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.703 -0.681 . . . . 14.77 110.561 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.439 ' OE1' ' HB3' ' A' ' 97' ' ' ASN . 1.6 mp0 -76.5 122.6 24.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.014 -0.539 . . . . 12.95 110.089 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 50.9 mt -70.57 108.56 2.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 109.993 -0.373 . . . . 11.11 109.993 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -72.78 -54.32 9.21 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.057 -0.52 . . . . 11.65 110.281 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -162.4 179.67 7.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.667 -0.697 . . . . 10.3 110.066 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 56.5 mt -115.64 117.89 57.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.222 -0.445 . . . . 10.29 110.468 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.604 HG21 HH22 ' B' ' 15' ' ' ARG . 33.4 mt -89.5 102.91 13.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.51 -0.552 . . . . 8.99 109.51 179.477 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.72 ' HB3' HG23 ' A' ' 90' ' ' THR . 99.5 m -97.15 112.69 24.36 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.227 0.537 . . . . 9.83 111.828 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.482 HG21 HG21 ' B' ' 13' ' ' ILE . 1.6 m -80.66 98.14 7.56 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 108.652 -0.87 . . . . 10.84 108.652 178.211 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.571 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 4.5 m-20 -80.55 99.84 8.29 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.148 -0.478 . . . . 11.26 111.544 -178.128 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.439 HG23 ' HB2' ' A' ' 11' ' ' GLU . 3.1 m -106.22 109.74 21.77 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.863 -0.608 . . . . 11.22 109.976 178.793 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ASN . . . . . 0.715 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 5.0 t-20 -75.19 134.88 41.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.881 0.372 . . . . 12.78 110.719 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.581 HG12 ' HG3' ' A' ' 114' ' ' LYS . 76.8 t -111.34 -50.55 6.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.91 -0.586 . . . . 14.64 109.9 179.388 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.581 ' HG3' HG12 ' A' ' 113' ' ' VAL . 61.3 mtpt . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.142 -0.932 . . . . 16.02 110.024 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 41.9 m . . . . . 0 N--CA 1.479 0.996 0 CA-C-O 121.05 0.453 . . . . 7.49 109.922 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 8' ' ' GLN . . . . . 0.468 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 26.4 mm-40 -124.88 135.94 27.38 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.287 -0.415 . . . . 7.12 110.604 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 9' ' ' PRO . . . . . 0.466 ' HD2' ' HG2' ' B' ' 28' ' ' ARG . 37.6 Cg_exo -61.06 154.8 54.49 Favored 'Trans proline' 0 CA--C 1.53 0.306 0 C-N-CA 122.763 2.308 . . . . 6.18 112.309 179.44 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.33 46.57 1.05 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.494 0.664 . . . . 5.81 110.654 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.635 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 62.3 tt0 -155.68 115.52 3.67 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.168 -0.923 . . . . 5.85 108.584 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 12' ' ' PHE . . . . . 0.654 ' HB3' ' HB2' ' B' ' 28' ' ' ARG . 33.9 p90 -137.23 155.99 48.84 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.505 0.557 . . . . 6.08 112.505 -178.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.495 HG13 HG23 ' B' ' 107' ' ' ILE . 3.4 tt -84.8 118.94 32.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.42 -0.809 . . . . 5.57 110.741 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.76 100.87 10.41 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.042 -0.527 . . . . 5.3 110.008 179.488 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 15' ' ' ARG . . . . . 0.604 HH22 HG21 ' A' ' 107' ' ' ILE . 9.4 mtp180 -88.88 105.1 17.52 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.882 -0.414 . . . . 8.97 109.882 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 34.5 p80 -131.71 155.94 46.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.952 -0.567 . . . . 8.31 110.217 -179.542 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -74.58 173.42 10.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.62 -0.264 . . . . 10.83 110.406 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.5 pt -56.78 -31.15 34.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 N-CA-C 112.846 0.684 . . . . 8.89 112.846 -178.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -71.15 -27.52 63.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.021 0.439 . . . . 11.92 111.254 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 117.82 -2.97 17.35 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.565 -0.826 . . . . 8.57 112.664 179.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' ILE . . . . . 0.406 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 19.3 mm -75.31 123.51 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 110.152 -0.314 . . . . 10.87 110.152 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 22' ' ' PHE . . . . . 0.542 ' CZ ' ' HB ' ' B' ' 45' ' ' ILE . 97.2 m-85 -74.74 130.65 39.87 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.877 0.37 . . . . 8.23 111.254 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 19.4 m -102.38 -39.95 6.94 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.982 -0.554 . . . . 7.91 110.309 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' PHE . . . . . 0.439 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 44.0 t80 -152.12 134.03 14.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.945 -0.57 . . . . 7.89 109.897 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 2.0 m -131.56 156.66 42.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.539 -0.301 . . . . 6.1 110.589 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' ASP . . . . . 0.555 ' HB3' ' HB2' ' B' ' 12' ' ' PHE . 11.8 t70 -81.95 158.98 23.7 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.04 -0.527 . . . . 7.15 110.466 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -67.92 -17.7 64.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.306 -0.406 . . . . 8.97 111.475 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' ARG . . . . . 0.654 ' HB2' ' HB3' ' B' ' 12' ' ' PHE . 65.5 mtm180 -62.98 -16.82 60.96 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.255 -0.429 . . . . 9.76 111.858 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 29.3 p -60.21 -36.3 77.36 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.749 0.309 . . . . 11.56 111.654 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' VAL . . . . . 0.477 ' O ' ' HA2' ' B' ' 34' ' ' GLY . 47.3 t -63.25 -31.42 52.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.972 -0.558 . . . . 13.64 111.34 -179.231 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -91.16 -21.09 21.34 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.809 0.338 . . . . 12.9 111.308 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 26.0 m -82.92 -57.05 3.46 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.066 0.395 . . . . 12.13 112.066 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 33' ' ' VAL . . . . . 0.553 HG11 ' HD2' ' B' ' 78' ' ' PHE . 0.2 OUTLIER -117.31 -11.68 11.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 111.83 0.307 . . . . 13.87 111.83 -179.391 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 34' ' ' GLY . . . . . 0.477 ' HA2' ' O ' ' B' ' 30' ' ' VAL . . . 90.01 -0.82 79.57 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.506 -0.854 . . . . 13.79 112.364 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 -79.57 132.51 36.31 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.654 0.264 . . . . 15.38 111.033 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 36' ' ' GLN . . . . . 0.456 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 80.8 mm-40 -76.6 147.12 77.96 Favored Pre-proline 0 C--N 1.321 -0.674 0 N-CA-C 107.993 -1.114 . . . . 13.78 107.993 177.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.632 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 72.5 Cg_exo -49.86 -39.93 48.66 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.561 2.174 . . . . 14.71 112.878 -179.357 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -66.93 -17.03 64.72 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.914 -0.584 . . . . 17.54 112.531 -179.088 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.456 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 33.2 mt-10 -78.74 -32.21 46.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.885 0.374 . . . . 14.24 110.648 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' B' ' 22' ' ' PHE . 1.8 mm? -82.88 -30.7 28.34 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.067 -0.515 . . . . 14.03 110.985 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.632 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 58.8 mt -61.7 104.8 0.47 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.253 -0.43 . . . . 13.62 111.668 -179.114 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 100.69 5.81 53.38 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.85 -0.69 . . . . 11.62 112.85 179.377 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.666 ' HE2' ' HA ' ' B' ' 43' ' ' LYS . 6.1 mmpt? -118.85 157.31 27.86 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.612 0.244 . . . . 13.82 110.68 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 44' ' ' ASN . . . . . 0.791 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 18.8 m120 -93.4 137.1 33.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.235 -0.438 . . . . 10.16 110.177 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 45' ' ' ILE . . . . . 0.542 ' HB ' ' CZ ' ' B' ' 22' ' ' PHE . 14.1 tt -59.69 -29.42 42.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.143 0.497 . . . . 9.62 110.952 179.44 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 46' ' ' VAL . . . . . 0.422 HG12 ' HB3' ' B' ' 44' ' ' ASN . 7.9 p -69.63 -20.91 24.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.991 -0.549 . . . . 11.5 111.401 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 47' ' ' GLU . . . . . 0.791 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 38.6 mt-10 -74.15 -20.78 60.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.926 0.393 . . . . 11.89 110.935 -179.56 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 48' ' ' PHE . . . . . 0.407 ' HB2' ' CZ ' ' B' ' 78' ' ' PHE . 40.6 m-85 -112.04 18.87 18.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.101 0.477 . . . . 13.6 109.906 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 51.9 t -102.88 151.62 22.23 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.818 -0.628 . . . . 10.81 110.636 -179.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 50' ' ' HIS . . . . . 0.611 ' HB3' ' HB2' ' B' ' 53' ' ' ASP . 5.0 t-80 -57.36 130.22 80.56 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.835 -0.62 . . . . 11.49 109.472 178.767 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -46.49 -45.77 18.66 Favored 'Trans proline' 0 CA--C 1.534 0.481 0 C-N-CA 123.048 2.499 . . . . 11.35 113.587 -179.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -82.34 6.55 16.66 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.138 0.421 . . . . 9.28 112.138 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 53' ' ' ASP . . . . . 0.611 ' HB2' ' HB3' ' B' ' 50' ' ' HIS . 5.2 m-20 -125.1 -0.7 7.78 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.033 0.444 . . . . 7.52 110.498 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -64.4 -46.88 81.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.835 -0.62 . . . . 6.57 111.102 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 49.2 tp60 -61.51 -42.16 98.38 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.108 -0.497 . . . . 6.58 110.402 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 65.4 tp -59.44 -42.09 91.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.081 -0.509 . . . . 4.6 110.28 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.41 HD22 ' CZ ' ' B' ' 61' ' ' PHE . 0.5 OUTLIER -62.87 -49.95 72.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.089 -0.505 . . . . 6.4 110.043 179.356 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -58.18 -46.04 86.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.435 -0.802 . . . . 8.18 111.239 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -62.7 -38.69 91.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.095 -0.502 . . . . 6.07 111.197 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 31.0 m -68.74 -36.79 78.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.149 -0.478 . . . . 5.59 110.982 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 61' ' ' PHE . . . . . 0.593 ' O ' HG12 ' B' ' 64' ' ' VAL . 8.2 m-85 -62.51 -46.46 88.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.759 0.314 . . . . 7.73 110.738 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -67.04 -27.69 67.6 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.933 0.397 . . . . 6.89 110.555 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.543 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 18.2 mt-30 -72.53 -42.06 65.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.048 -0.524 . . . . 9.4 110.933 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.593 HG12 ' O ' ' B' ' 61' ' ' PHE . 3.2 p -66.04 -25.13 35.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.802 0.334 . . . . 7.57 110.31 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 65' ' ' VAL . . . . . 0.5 HG23 ' O ' ' B' ' 61' ' ' PHE . 89.3 t -72.22 -32.56 43.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 109.264 -0.643 . . . . 7.43 109.264 178.379 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -71.84 -34.72 69.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.65 -0.704 . . . . 10.21 110.182 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' B' ' 63' ' ' GLN . 24.3 mt -68.94 -51.18 42.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.772 -0.649 . . . . 7.2 109.975 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 31.1 mttt 59.44 102.31 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 O-C-N 124.12 0.887 . . . . 7.58 112.383 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.63 16.61 54.62 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.649 -0.786 . . . . 5.57 112.328 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -126.45 162.16 26.25 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 110.275 -0.269 . . . . 5.43 110.275 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 71' ' ' VAL . . . . . 0.4 ' HA ' ' O ' ' B' ' 92' ' ' SER . 24.8 t -106.88 121.09 59.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.342 -0.39 . . . . 5.65 111.125 -179.017 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 21.2 tp -115.81 104.09 11.3 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.216 -0.661 . . . . 4.51 109.216 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 73' ' ' SER . . . . . 0.476 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.4 m -86.21 117.97 25.37 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.908 -0.587 . . . . 6.35 111.032 -179.24 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.7 p -103.86 129.05 56.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.024 -0.534 . . . . 4.34 110.21 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 10.7 tpt -100.47 117.1 33.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.124 -0.489 . . . . 5.42 110.362 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -154.31 -171.91 4.03 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.393 -0.367 . . . . 3.54 110.205 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 77' ' ' ARG . . . . . 0.597 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 11.8 mtm180 -108.59 119.33 39.19 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.961 0.41 . . . . 6.8 110.62 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.553 ' HD2' HG11 ' B' ' 33' ' ' VAL . 19.5 t80 -102.38 144.78 30.43 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.482 -0.781 . . . . 5.79 110.03 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 79' ' ' ARG . . . . . 0.562 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 35.7 ttp180 -80.34 136.54 36.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.725 0.298 . . . . 11.08 110.517 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 80' ' ' SER . . . . . 0.556 ' OG ' ' HG2' ' B' ' 84' ' ' GLU . 88.9 p -99.26 -176.34 3.27 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.866 -0.42 . . . . 7.47 109.866 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 81' ' ' LYS . . . . . 0.425 ' HA ' ' HD2' ' B' ' 81' ' ' LYS . 32.2 tptt -70.19 -10.42 58.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.566 0.698 . . . . 12.24 109.688 178.762 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 33.2 m-20 -96.39 3.49 52.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.416 -0.811 . . . . 9.25 109.796 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 67.49 17.5 10.04 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.511 -0.768 . . . . 8.3 111.327 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 84' ' ' GLU . . . . . 0.556 ' HG2' ' OG ' ' B' ' 80' ' ' SER . 7.1 pt-20 -94.91 158.94 15.26 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.236 -0.653 . . . . 6.78 109.236 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 85' ' ' TRP . . . . . 0.597 ' HB3' ' HB3' ' B' ' 77' ' ' ARG . 42.2 m95 -106.48 108.65 20.27 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 121.03 -0.268 . . . . 7.89 110.631 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' B' ' 77' ' ' ARG . 1.9 pp -105.57 152.68 22.77 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.345 -0.388 . . . . 6.97 110.129 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 87' ' ' TRP . . . . . 0.79 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 95.1 m95 -80.88 120.32 24.56 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.034 0.445 . . . . 8.55 110.835 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 2.0 ttp -132.0 140.48 48.95 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.929 -0.578 . . . . 4.46 110.889 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 28.5 ttp180 -103.01 93.89 5.26 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.776 -0.647 . . . . 6.87 109.36 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 90' ' ' THR . . . . . 0.545 ' CG2' ' HB3' ' B' ' 108' ' ' CYS . 6.4 m -78.47 105.37 9.69 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.014 -0.539 . . . . 6.18 111.281 -179.319 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 91' ' ' SER . . . . . 0.476 ' HA ' ' HA ' ' B' ' 73' ' ' SER . 0.9 OUTLIER -84.05 94.86 8.41 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.65 -0.704 . . . . 6.3 109.973 179.657 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 92' ' ' SER . . . . . 0.4 ' O ' ' HA ' ' B' ' 71' ' ' VAL . 8.6 m -84.73 127.18 33.98 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.366 -0.379 . . . . 6.65 111.939 -178.484 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -125.24 131.0 53.2 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.21 -0.45 . . . . 6.45 109.904 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 94' ' ' THR . . . . . 0.446 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.0 OUTLIER -89.28 114.36 25.72 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.472 -0.331 . . . . 9.17 110.797 179.644 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -102.45 122.81 45.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.917 0.389 . . . . 8.33 110.423 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -106.6 147.65 29.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.968 -0.56 . . . . 10.53 110.533 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 97' ' ' ASN . . . . . 0.432 ' HB3' ' CD2' ' B' ' 99' ' ' TYR . 3.4 m-80 -85.11 147.25 47.26 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 115.972 -0.558 . . . . 8.43 110.221 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -78.61 49.83 3.21 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.8 2.333 . . . . 9.16 112.999 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 99' ' ' TYR . . . . . 0.432 ' CD2' ' HB3' ' B' ' 97' ' ' ASN . 51.3 m-85 -128.71 -58.14 1.17 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.999 0.428 . . . . 11.34 110.366 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.13 21.01 2.8 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.191 -0.459 . . . . 7.75 110.538 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 32.7 t70 62.83 32.76 15.7 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.779 0.8 . . . . 9.08 110.005 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -85.7 140.42 30.54 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.481 -0.781 . . . . 7.71 110.783 -179.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 25.5 mt -84.94 117.74 30.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.322 -0.399 . . . . 8.04 110.028 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -75.7 -46.37 31.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.909 0.385 . . . . 8.81 110.045 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -165.49 172.48 12.05 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.796 -0.638 . . . . 7.4 109.643 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 54.3 mt -106.37 115.89 48.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 109.952 -0.388 . . . . 6.78 109.952 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.495 HG23 HG13 ' B' ' 13' ' ' ILE . 77.0 mt -81.9 105.55 11.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.753 -0.658 . . . . 6.31 109.741 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 108' ' ' CYS . . . . . 0.545 ' HB3' ' CG2' ' B' ' 90' ' ' THR . 94.4 m -107.85 99.0 8.51 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 120.863 0.363 . . . . 5.31 111.948 -179.101 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 94.4 m -75.64 105.54 6.73 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.413 -0.958 . . . . 5.48 108.413 177.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 110' ' ' ASN . . . . . 0.634 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 3.7 m-20 -81.85 101.18 10.03 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.718 -0.674 . . . . 6.9 111.671 -178.108 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 20.4 m -101.56 107.43 18.71 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.814 -0.63 . . . . 8.61 110.301 179.28 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 112' ' ' ASN . . . . . 0.424 HD22 HD13 ' B' ' 86' ' ' LEU . 8.9 t-20 -70.86 135.76 48.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.787 0.327 . . . . 11.84 110.502 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 37.1 t -113.37 -53.46 5.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.005 -0.543 . . . . 11.77 110.009 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 114' ' ' LYS . . . . . 0.79 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 46.4 mtpt . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.283 -0.865 . . . . 12.68 109.817 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.0 m . . . . . 0 N--CA 1.476 0.842 0 N-CA-C 110.011 -0.366 . . . . 15.6 110.011 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 78.6 mm-40 -109.06 109.0 60.89 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 109.582 -0.525 . . . . 15.08 109.582 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -61.12 150.83 82.5 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 123.089 2.526 . . . . 13.43 112.32 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.812 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.0 OUTLIER -82.96 51.39 1.92 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.27 0.557 . . . . 11.09 110.8 -179.861 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.632 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 30.7 tt0 -153.71 116.26 4.42 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.602 -0.888 . . . . 10.59 108.602 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.998 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 41.3 p90 -130.95 166.39 21.07 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.984 0.421 . . . . 8.93 111.579 -178.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.559 HD13 HG23 ' A' ' 109' ' ' THR . 30.9 mm -94.77 121.28 45.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.854 -0.612 . . . . 8.66 110.665 -179.723 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.626 ' HB3' ' HE2' ' A' ' 22' ' ' PHE . 0.7 OUTLIER -106.54 97.1 6.93 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.159 -0.473 . . . . 6.11 110.878 179.588 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.439 ' HB2' ' HB3' ' A' ' 24' ' ' PHE . 3.5 mtt180 -83.17 102.41 11.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.763 -0.829 . . . . 9.09 108.763 178.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.446 ' O ' ' HB2' ' A' ' 105' ' ' TYR . 34.4 p80 -132.18 158.7 41.03 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 121.149 -0.22 . . . . 9.79 111.265 -178.555 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -77.92 178.23 7.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.487 -0.324 . . . . 12.69 110.235 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 22.2 pt -54.55 -37.04 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 113.374 0.879 . . . . 13.58 113.374 -178.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -73.17 -25.66 60.88 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.039 0.447 . . . . 13.85 111.568 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 116.35 1.09 20.39 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.449 -0.882 . . . . 9.38 112.198 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.434 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 37.0 mm -67.89 114.37 4.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 109.728 -0.471 . . . . 10.74 109.728 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.626 ' HE2' ' HB3' ' A' ' 14' ' ' SER . 78.8 m-85 -67.32 126.27 28.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.143 -0.48 . . . . 9.73 110.907 -179.703 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.2 m -106.29 -26.02 11.7 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.68 -0.691 . . . . 7.74 109.754 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.46 ' HE2' ' HE1' ' B' ' 95' ' ' PHE . 78.1 t80 -152.42 116.2 4.83 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.646 -0.706 . . . . 6.92 109.615 179.273 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.604 HG21 ' HB2' ' A' ' 40' ' ' LEU . 19.3 t -112.27 127.48 69.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.347 -0.388 . . . . 6.02 110.763 -179.509 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.998 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 10.1 t70 -66.38 136.28 55.54 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.145 -0.48 . . . . 7.31 110.08 179.4 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -57.61 -16.3 9.99 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.896 0.702 . . . . 11.67 112.896 -179.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.472 ' HB2' ' HB3' ' A' ' 12' ' ' PHE . 80.1 mtm180 -67.95 -10.57 54.51 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.216 -0.302 . . . . 11.91 111.077 179.38 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 29.1 p -59.89 -31.46 69.82 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.726 0.298 . . . . 12.99 110.914 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 20.4 t -65.01 -36.55 78.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.185 -0.461 . . . . 16.15 110.823 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.05 -16.27 38.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.933 0.397 . . . . 15.07 110.922 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.79 ' HA ' HG22 ' A' ' 10' ' ' THR . 25.8 m -87.97 -56.64 3.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.019 -0.537 . . . . 14.9 111.594 -179.579 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.65 ' HB ' ' HA ' ' A' ' 80' ' ' SER . 7.7 m -121.47 -19.41 4.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 111.924 0.342 . . . . 13.84 111.924 -179.49 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.2 -18.27 56.82 Favored Glycine 0 N--CA 1.454 -0.145 0 C-N-CA 120.602 -0.809 . . . . 13.85 112.273 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.461 ' H ' HG23 ' A' ' 33' ' ' VAL . 5.7 m-85 -66.37 136.92 56.46 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.624 0.249 . . . . 18.28 110.483 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.481 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 15.2 mm100 -76.24 150.6 83.01 Favored Pre-proline 0 C--N 1.326 -0.437 0 N-CA-C 109.37 -0.604 . . . . 15.48 109.37 179.207 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.537 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 52.6 Cg_exo -52.47 -41.97 64.27 Favored 'Trans proline' 0 CA--C 1.527 0.162 0 C-N-CA 122.529 2.153 . . . . 11.63 112.528 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.487 ' HA ' HD12 ' A' ' 41' ' ' LEU . 23.4 mp0 -69.24 -19.19 63.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.025 -0.534 . . . . 13.31 111.839 -179.174 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.481 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 36.7 mt-10 -73.45 -24.05 60.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.945 0.402 . . . . 17.34 110.426 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.604 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.8 mm? -93.45 -28.49 16.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.071 -0.513 . . . . 13.25 110.286 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 91.8 mt -61.17 131.8 51.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.925 -0.579 . . . . 12.99 110.772 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 75.99 11.72 84.54 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.928 -0.653 . . . . 13.39 112.681 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.783 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 7.9 mmpt? -129.47 159.61 35.74 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.696 0.284 . . . . 16.87 110.388 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.4 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 13.3 m120 -94.02 138.23 32.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.157 -0.474 . . . . 12.5 110.197 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.41 HG13 ' HE1' ' A' ' 78' ' ' PHE . 17.2 tt -60.25 -25.7 34.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.013 -0.539 . . . . 11.72 111.3 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.8 p -68.38 -20.84 25.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 116.342 -0.39 . . . . 12.89 111.413 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.4 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 39.1 mt-10 -76.99 -23.62 52.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.048 0.451 . . . . 16.53 110.4 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -106.11 15.09 26.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.885 -0.598 . . . . 15.34 109.984 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 17.1 t -106.62 147.98 28.86 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.461 -0.79 . . . . 11.97 110.843 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.415 ' CD2' ' HD2' ' A' ' 51' ' ' PRO . 7.4 t-160 -57.76 127.76 79.19 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 115.58 -0.736 . . . . 14.67 109.36 178.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.415 ' HD2' ' CD2' ' A' ' 50' ' ' HIS . 80.7 Cg_exo -45.18 -52.17 6.82 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.475 2.783 . . . . 15.15 113.976 -179.136 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -67.67 -8.91 38.77 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.315 0.487 . . . . 16.47 112.315 -179.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.542 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 27.8 m-20 -114.84 -1.48 13.18 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.793 0.33 . . . . 13.16 110.893 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.402 ' OE1' ' HA ' ' A' ' 51' ' ' PRO . 83.5 mt-30 -62.39 -46.2 89.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.24 -0.436 . . . . 15.83 111.099 -179.468 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -63.01 -38.19 90.19 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.64 -0.504 . . . . 13.94 109.64 178.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.3 tp -61.7 -43.35 99.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.626 -0.716 . . . . 12.11 109.925 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.438 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.3 OUTLIER -63.99 -52.52 59.2 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.781 -0.645 . . . . 9.71 110.706 179.487 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 33.6 ttt180 -58.22 -46.3 86.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.319 -0.4 . . . . 11.06 111.385 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.473 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 34.7 t70 -61.5 -45.58 93.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.71 -0.223 . . . . 9.71 110.914 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 45.2 m -63.61 -37.53 87.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.972 0.415 . . . . 9.52 110.557 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.5 ' O ' HG23 ' A' ' 65' ' ' VAL . 2.8 m-30 -63.3 -37.33 86.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.106 -0.497 . . . . 11.4 109.993 178.841 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 92.9 mm-40 -73.32 -33.06 64.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.182 -0.463 . . . . 10.04 109.92 178.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.473 ' HG3' ' O ' ' A' ' 59' ' ' ASP . 52.9 mt-30 -63.53 -45.33 91.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.878 -0.601 . . . . 10.6 110.991 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.499 HG12 ' O ' ' A' ' 61' ' ' PHE . 6.3 p -65.29 -25.23 36.71 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-N 116.538 -0.301 . . . . 10.62 111.472 -179.231 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 61' ' ' PHE . 79.5 t -70.82 -32.77 50.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 109.405 -0.591 . . . . 12.41 109.405 178.801 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 34.8 mtpt -82.56 -18.31 41.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.43 -0.805 . . . . 16.25 110.245 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 92.1 mt -83.03 -54.16 5.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.012 -0.54 . . . . 12.66 109.967 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 57.6 mttt 61.4 94.98 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.914 0.759 . . . . 14.83 112.814 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 107.17 -25.48 21.87 Favored Glycine 0 N--CA 1.454 -0.109 0 C-N-CA 120.423 -0.894 . . . . 9.8 113.753 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -90.33 131.54 36.07 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.156 -0.313 . . . . 9.59 110.156 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.46 ' HB ' ' HZ ' ' B' ' 24' ' ' PHE . 3.7 p -77.54 113.07 16.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.269 0.557 . . . . 8.1 110.491 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 33.3 tp -102.19 100.16 10.34 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.038 -0.528 . . . . 7.8 110.602 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.429 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 0.0 OUTLIER -81.66 115.01 20.72 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.607 -0.724 . . . . 7.59 110.363 179.478 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 p -109.52 122.95 64.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.915 0.388 . . . . 7.84 110.172 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 27.7 ttt -97.17 111.96 23.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.261 -0.427 . . . . 9.35 111.065 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.542 ' HB2' ' HB3' ' A' ' 53' ' ' ASP . 48.3 p90 -140.49 -173.47 3.69 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.195 -0.669 . . . . 9.66 109.195 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.455 ' HB3' ' HB3' ' A' ' 85' ' ' TRP . 12.9 mtm180 -105.59 122.17 45.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.105 0.479 . . . . 13.1 110.649 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.41 ' HE1' HG13 ' A' ' 45' ' ' ILE . 23.1 t80 -104.27 152.61 22.01 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.671 -0.695 . . . . 9.28 110.203 -179.124 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.616 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 46.9 ttp180 -92.83 128.43 38.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.871 0.367 . . . . 10.87 111.018 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.65 ' HA ' ' HB ' ' A' ' 33' ' ' VAL . 77.5 p -90.76 -176.63 4.75 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.698 -0.482 . . . . 10.77 109.698 179.117 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.443 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 40.3 tptt -71.41 -12.2 61.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.376 0.608 . . . . 12.66 109.614 178.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -90.84 2.98 55.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.404 -0.816 . . . . 14.42 109.342 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 65.24 23.72 12.22 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 115.029 -0.987 . . . . 12.69 111.104 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.494 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.6 pt-20 -99.2 160.15 14.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 10.85 109.888 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.616 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 64.8 m95 -106.47 110.66 22.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.521 -0.309 . . . . 11.2 110.638 -179.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.432 ' H ' ' HG ' ' A' ' 86' ' ' LEU . 0.8 OUTLIER -113.72 154.94 26.47 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.264 -0.426 . . . . 11.12 110.072 179.643 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.437 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 97.9 m95 -75.04 120.5 20.65 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.247 0.546 . . . . 10.28 111.416 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 47.8 tpp -119.44 130.71 55.4 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.221 -0.9 . . . . 9.32 110.416 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.515 ' HB3' ' HB ' ' A' ' 111' ' ' THR . 3.1 ttp180 -101.87 73.97 1.44 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.042 -0.725 . . . . 10.66 109.042 178.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.644 HG23 ' HB3' ' A' ' 108' ' ' CYS . 52.3 m -64.34 114.43 4.27 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.694 -0.685 . . . . 9.37 111.651 -179.242 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.595 ' O ' ' HA ' ' A' ' 108' ' ' CYS . 0.7 OUTLIER -89.75 94.45 9.84 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.385 -0.825 . . . . 8.27 109.873 179.948 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.431 ' HA ' ' SG ' ' A' ' 108' ' ' CYS . 5.3 m -77.5 117.45 18.96 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.982 0.42 . . . . 8.65 111.532 -179.057 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -122.91 117.55 25.82 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.837 -0.619 . . . . 11.56 109.77 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.56 127.75 33.6 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.227 -0.442 . . . . 10.16 111.664 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -104.03 118.53 36.89 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.586 -0.524 . . . . 12.25 109.586 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -108.54 149.17 29.22 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.215 0.531 . . . . 14.24 111.928 -178.603 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.47 ' HA ' ' HD3' ' A' ' 98' ' ' PRO . 12.0 t-20 -97.19 132.89 24.75 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 115.36 -0.836 . . . . 13.83 109.612 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' A' ' 97' ' ' ASN . 27.5 Cg_exo -63.27 -6.31 9.74 Favored 'Trans proline' 0 N--CA 1.476 0.486 0 C-N-CA 123.358 2.705 . . . . 15.34 114.467 -178.612 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -62.84 -61.51 2.36 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.643 0.258 . . . . 16.89 110.436 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -145.31 27.95 1.23 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.736 0.303 . . . . 14.89 111.0 179.096 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 27.7 t70 63.52 41.9 7.0 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.529 -0.759 . . . . 14.77 111.782 179.202 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -91.36 142.47 27.65 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.351 -0.386 . . . . 12.95 110.067 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 48.9 mt -88.75 102.3 12.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.047 -0.353 . . . . 11.11 110.047 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.482 ' H ' ' HG2' ' A' ' 104' ' ' GLU . 2.5 pt-20 -71.26 -41.37 70.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.71 0.291 . . . . 11.65 110.974 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.446 ' HB2' ' O ' ' A' ' 16' ' ' HIS . 20.6 p90 -161.6 178.96 8.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.777 0.322 . . . . 10.3 110.642 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 44.4 mt -122.24 123.24 68.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.092 -0.504 . . . . 10.29 110.634 -179.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.626 HG21 HH22 ' B' ' 15' ' ' ARG . 85.8 mt -91.12 112.7 25.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.11 -0.7 . . . . 8.99 109.11 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.644 ' HB3' HG23 ' A' ' 90' ' ' THR . 96.8 m -113.76 116.59 29.63 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.372 0.508 . . . . 9.83 112.372 -178.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.559 HG23 HD13 ' A' ' 13' ' ' ILE . 0.2 OUTLIER -82.92 110.55 18.0 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.69 -0.856 . . . . 10.84 108.69 177.865 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.632 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 3.9 m-20 -85.56 98.33 10.58 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.882 0.372 . . . . 11.26 111.448 -178.23 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.515 ' HB ' ' HB3' ' A' ' 89' ' ' ARG . 1.3 m -93.75 110.55 22.18 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.756 -0.657 . . . . 11.22 111.165 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ASN . . . . . 0.812 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 3.8 t-20 -75.64 111.93 11.48 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.588 -0.523 . . . . 12.78 109.588 178.719 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' VAL . . . . . 0.486 HG12 ' HG3' ' A' ' 114' ' ' LYS . 39.5 t -91.4 -53.41 8.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 116.072 -0.513 . . . . 14.64 110.488 -179.578 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.486 ' HG3' HG12 ' A' ' 113' ' ' VAL . 54.7 mtpt . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.406 -0.806 . . . . 16.02 110.056 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 18.8 m . . . . . 0 N--CA 1.478 0.96 0 CA-C-O 120.716 0.294 . . . . 7.49 110.295 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 8' ' ' GLN . . . . . 0.749 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 33.5 mm-40 -75.81 146.18 79.24 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.386 -0.37 . . . . 7.12 110.94 -179.362 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 9' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' B' ' 8' ' ' GLN . 5.5 Cg_exo -80.54 -167.41 0.5 Allowed 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 123.276 2.651 . . . . 6.18 112.812 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 10' ' ' THR . . . . . 0.738 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.1 OUTLIER -99.32 47.04 0.96 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.218 0.532 . . . . 5.81 110.936 -179.707 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.503 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -151.76 151.53 31.51 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.543 -0.91 . . . . 5.85 108.543 179.593 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 12' ' ' PHE . . . . . 0.631 ' HB2' ' HB3' ' B' ' 26' ' ' ASP . 18.8 p90 -161.32 158.72 27.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.412 0.625 . . . . 6.08 112.019 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.539 HG13 HG21 ' A' ' 109' ' ' THR . 24.7 mm -85.51 118.81 32.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.091 -0.959 . . . . 5.57 110.542 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.443 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.8 OUTLIER -112.79 89.2 3.01 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.199 -0.455 . . . . 5.3 110.761 179.9 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 15' ' ' ARG . . . . . 0.626 HH22 HG21 ' A' ' 107' ' ' ILE . 8.1 mtp180 -83.4 110.83 18.48 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.387 -0.597 . . . . 8.97 109.387 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 16' ' ' HIS . . . . . 0.522 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 33.6 p80 -136.68 162.53 32.9 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.548 -0.296 . . . . 8.31 110.616 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -78.14 174.97 10.59 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.208 -0.293 . . . . 10.83 110.208 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 27.0 pt -59.71 -24.11 28.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 113.109 0.781 . . . . 8.89 113.109 -178.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -77.54 -22.01 51.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.935 0.398 . . . . 11.92 110.981 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 112.72 -7.82 25.94 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.558 -0.83 . . . . 8.57 112.368 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 33.9 mm -69.71 116.71 11.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 110.186 -0.301 . . . . 10.87 110.186 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 22' ' ' PHE . . . . . 0.522 ' HA ' ' HB3' ' B' ' 16' ' ' HIS . 94.7 m-85 -66.13 121.4 15.07 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.091 -0.504 . . . . 8.23 111.106 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -92.19 -40.25 11.11 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.779 -0.646 . . . . 7.91 110.363 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 24' ' ' PHE . . . . . 0.46 ' HZ ' ' HB ' ' A' ' 71' ' ' VAL . 47.6 t80 -155.44 120.87 4.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.101 -0.499 . . . . 7.89 110.29 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 10.6 m -115.86 154.68 17.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.032 0.444 . . . . 6.1 111.218 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' ASP . . . . . 0.631 ' HB3' ' HB2' ' B' ' 12' ' ' PHE . 9.2 t70 -74.47 165.03 25.88 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.428 -0.806 . . . . 7.15 110.233 179.48 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 4.2 m170 -82.27 -8.7 59.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.838 0.352 . . . . 8.97 110.981 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' ARG . . . . . 0.749 ' HG2' ' HB3' ' B' ' 8' ' ' GLN . 72.1 mtm180 -69.1 -14.62 63.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.006 -0.543 . . . . 9.76 111.974 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 28.4 p -57.28 -31.66 65.84 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 111.725 0.269 . . . . 11.56 111.725 -178.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 25.1 t -63.05 -38.74 82.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.205 -0.452 . . . . 13.64 111.108 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.04 -17.57 30.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.771 0.32 . . . . 12.9 110.968 179.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 41.5 m -80.39 -58.82 2.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.167 -0.47 . . . . 12.13 111.849 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 33' ' ' VAL . . . . . 0.505 ' HB ' ' HA ' ' B' ' 80' ' ' SER . 3.5 m -127.68 -2.07 3.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 112.24 0.459 . . . . 13.87 112.24 -178.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.29 -19.94 28.85 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.705 -0.759 . . . . 13.79 112.564 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 35' ' ' TYR . . . . . 0.442 ' HB2' HG23 ' B' ' 33' ' ' VAL . 4.2 m-85 -62.95 129.63 41.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.708 0.29 . . . . 15.38 110.668 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 36' ' ' GLN . . . . . 0.588 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 17.9 mm100 -73.74 151.89 89.1 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 109.54 -0.541 . . . . 13.78 109.54 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.504 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 61.3 Cg_exo -51.58 -38.86 65.85 Favored 'Trans proline' 0 CA--C 1.53 0.32 0 C-N-CA 122.757 2.304 . . . . 14.71 112.778 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 24.3 mp0 -71.44 -13.38 61.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.883 -0.599 . . . . 17.54 111.821 -179.203 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.588 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 30.4 mt-10 -85.14 -19.8 31.24 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.8 0.333 . . . . 14.24 110.293 179.591 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -92.24 -45.1 8.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.016 -0.538 . . . . 14.03 110.377 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 51.5 mt -58.56 126.39 27.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.009 -0.541 . . . . 13.62 111.211 -179.249 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.53 -5.16 83.99 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.778 -0.646 . . . . 11.62 112.261 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.804 ' HE2' ' HA ' ' B' ' 43' ' ' LYS . 6.7 mmpt? -112.05 160.05 17.87 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 122.758 -0.26 . . . . 13.82 110.433 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 44' ' ' ASN . . . . . 0.826 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 17.7 m120 -92.61 138.12 31.78 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.601 -0.518 . . . . 10.16 109.601 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 45' ' ' ILE . . . . . 0.438 ' HB ' ' CZ ' ' B' ' 22' ' ' PHE . 14.4 tt -62.9 -28.07 44.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.034 0.445 . . . . 9.62 111.055 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 5.1 p -71.5 -18.64 20.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-N 116.224 -0.444 . . . . 11.5 111.72 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 47' ' ' GLU . . . . . 0.826 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 42.9 mt-10 -69.57 -37.41 76.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.902 0.382 . . . . 11.89 110.968 -179.344 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 -98.74 18.19 17.53 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.023 0.439 . . . . 13.6 110.405 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 41.1 t -101.65 145.67 28.77 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.888 -0.596 . . . . 10.81 110.616 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 50' ' ' HIS . . . . . 0.482 ' CD2' ' HD2' ' B' ' 51' ' ' PRO . 5.5 t-160 -55.64 128.61 69.32 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.537 -0.756 . . . . 11.49 109.92 178.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 51' ' ' PRO . . . . . 0.482 ' HD2' ' CD2' ' B' ' 50' ' ' HIS . 95.7 Cg_exo -44.57 -51.72 6.81 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 123.516 2.811 . . . . 11.35 113.628 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -70.07 -4.19 19.98 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.184 0.439 . . . . 9.28 112.184 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 53' ' ' ASP . . . . . 0.435 ' HB3' ' HB2' ' B' ' 76' ' ' PHE . 53.5 m-20 -120.54 -0.32 10.32 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.866 0.365 . . . . 7.52 110.502 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -62.72 -43.51 98.62 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.97 -0.559 . . . . 6.57 111.209 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 48.6 tp60 -69.41 -39.31 77.97 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.425 -0.352 . . . . 6.58 110.189 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 58.0 tp -59.64 -39.81 85.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 4.6 110.483 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.42 HD22 ' CZ ' ' B' ' 61' ' ' PHE . 0.7 OUTLIER -62.85 -50.42 71.0 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.003 -0.544 . . . . 6.4 110.33 179.267 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 52.8 ttt180 -61.43 -43.45 98.85 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.103 -0.499 . . . . 8.18 110.923 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 59' ' ' ASP . . . . . 0.444 ' O ' ' HG3' ' B' ' 63' ' ' GLN . 25.3 t70 -60.0 -46.52 89.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.812 0.339 . . . . 6.07 110.296 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 36.6 m -61.42 -34.2 74.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.959 -0.564 . . . . 5.59 110.426 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 61' ' ' PHE . . . . . 0.49 ' O ' HG12 ' B' ' 64' ' ' VAL . 10.7 m-85 -65.35 -39.8 92.82 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.295 0.569 . . . . 7.73 109.535 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -67.4 -35.55 79.52 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.802 -0.636 . . . . 6.89 110.171 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' B' ' 59' ' ' ASP . 34.8 mt-30 -69.28 -44.51 71.69 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.941 -0.572 . . . . 9.4 111.514 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.56 ' HA ' HD12 ' B' ' 67' ' ' LEU . 9.9 p -63.49 -29.22 46.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-O 120.719 0.295 . . . . 7.57 110.692 -179.468 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 65' ' ' VAL . . . . . 0.686 ' HA ' HG21 ' B' ' 94' ' ' THR . 61.3 t -70.44 -35.48 62.24 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.1 0 N-CA-C 109.638 -0.505 . . . . 7.43 109.638 178.539 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -67.66 -39.97 84.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.843 -0.617 . . . . 10.21 110.039 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.56 HD12 ' HA ' ' B' ' 64' ' ' VAL . 25.6 mt -66.17 -49.0 68.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.564 -0.744 . . . . 7.2 110.082 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 14.6 tttt 60.75 98.41 0.03 OUTLIER 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.474 -0.785 . . . . 7.58 112.228 179.314 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.83 20.36 34.16 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.751 -0.738 . . . . 5.57 112.427 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -124.89 154.06 41.67 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.569 -0.53 . . . . 5.43 109.569 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 71' ' ' VAL . . . . . 0.589 ' CG2' ' HB3' ' B' ' 91' ' ' SER . 2.7 p -103.96 117.36 49.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-O 121.283 0.564 . . . . 5.65 110.582 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 13.0 tp -108.86 111.05 22.56 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.773 -0.649 . . . . 4.51 110.09 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 73' ' ' SER . . . . . 0.575 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 12.7 m -87.06 112.18 21.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.233 -0.44 . . . . 6.35 111.117 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.2 p -108.82 131.19 60.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.039 -0.528 . . . . 4.34 110.061 179.304 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 25.4 ttt -100.85 115.11 29.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.077 0.465 . . . . 5.42 110.912 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.483 ' HE1' ' HB ' ' B' ' 90' ' ' THR . 50.7 p90 -143.99 178.17 8.04 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.649 -0.705 . . . . 3.54 109.456 179.662 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 77' ' ' ARG . . . . . 0.56 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 12.1 mtm180 -101.09 122.23 43.21 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.998 0.428 . . . . 6.8 110.112 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.432 ' HD1' ' HE2' ' B' ' 76' ' ' PHE . 25.5 t80 -105.78 145.81 30.68 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.604 -0.726 . . . . 5.79 110.119 -179.399 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 79' ' ' ARG . . . . . 0.547 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 30.4 ttt180 -87.22 122.35 30.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.141 -0.481 . . . . 11.08 110.782 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 80' ' ' SER . . . . . 0.505 ' HA ' ' HB ' ' B' ' 33' ' ' VAL . 76.5 p -86.37 -176.81 6.03 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.085 -0.507 . . . . 7.47 109.746 179.028 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 81' ' ' LYS . . . . . 0.417 ' HA ' ' HD2' ' B' ' 81' ' ' LYS . 35.5 tptt -70.63 -13.06 61.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.496 0.665 . . . . 12.24 109.581 178.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -88.61 0.03 56.79 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.595 -0.73 . . . . 9.25 109.626 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 69.76 20.19 6.93 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.393 -0.821 . . . . 8.3 110.832 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 84' ' ' GLU . . . . . 0.435 ' O ' ' HA ' ' B' ' 79' ' ' ARG . 2.8 pt-20 -98.94 151.4 20.93 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.348 -0.387 . . . . 6.78 110.118 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 85' ' ' TRP . . . . . 0.56 ' HB3' ' HB3' ' B' ' 77' ' ' ARG . 44.2 m95 -100.76 103.2 14.43 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.246 -0.434 . . . . 7.89 110.587 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.43 ' H ' ' HG ' ' B' ' 86' ' ' LEU . 0.8 OUTLIER -103.46 151.84 22.35 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.221 -0.445 . . . . 6.97 110.346 179.642 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 87' ' ' TRP . . . . . 0.684 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 89.7 m95 -76.37 114.4 15.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.246 0.546 . . . . 8.55 110.759 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 21.4 tpp -115.21 129.89 56.77 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.216 -0.902 . . . . 4.46 110.792 -178.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 -99.49 85.07 3.08 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.566 -0.901 . . . . 6.87 108.566 178.332 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 90' ' ' THR . . . . . 0.492 HG23 ' HB3' ' B' ' 108' ' ' CYS . 22.7 m -78.82 113.19 16.7 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.759 -0.655 . . . . 6.18 111.86 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 91' ' ' SER . . . . . 0.629 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 20.3 m -93.66 87.7 5.58 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.63 -0.714 . . . . 6.3 109.815 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 92' ' ' SER . . . . . 0.57 ' HA ' ' HA ' ' B' ' 108' ' ' CYS . 14.4 m -72.74 128.75 36.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.903 -0.59 . . . . 6.65 111.419 -178.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -122.71 126.41 47.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.106 -0.497 . . . . 6.45 110.021 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 94' ' ' THR . . . . . 0.686 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.1 OUTLIER -83.3 107.7 16.01 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.709 0.29 . . . . 9.17 110.501 179.406 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 95' ' ' PHE . . . . . 0.46 ' HE1' ' HE2' ' A' ' 24' ' ' PHE . 0.3 OUTLIER -86.27 129.73 34.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.381 -0.372 . . . . 8.33 110.558 -179.466 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -108.48 131.51 54.74 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.011 -0.54 . . . . 10.53 111.028 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 97' ' ' ASN . . . . . 0.43 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 55.9 t30 -71.49 127.9 90.59 Favored Pre-proline 0 C--N 1.32 -0.706 0 N-CA-C 108.866 -0.79 . . . . 8.43 108.866 178.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 98' ' ' PRO . . . . . 0.43 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 57.4 Cg_endo -70.37 45.39 0.52 Allowed 'Trans proline' 0 CA--C 1.534 0.501 0 C-N-CA 123.175 2.583 . . . . 9.16 113.137 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -126.53 -54.22 1.45 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.44 -0.345 . . . . 11.34 110.702 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 48.5 m -137.11 21.43 3.01 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.745 -0.207 . . . . 7.75 111.201 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 25.4 t70 64.8 20.2 12.06 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 121.525 0.679 . . . . 9.08 110.492 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 4.3 pm0 -79.95 142.51 35.01 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.083 -0.508 . . . . 7.71 110.477 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 80.8 mt -76.53 110.86 12.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.751 -0.463 . . . . 8.04 109.751 179.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.435 ' H ' ' HG2' ' B' ' 104' ' ' GLU . 5.7 pt-20 -73.04 -45.09 59.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.555 -0.293 . . . . 8.81 110.468 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -168.56 165.61 12.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.939 0.4 . . . . 7.4 110.758 179.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 32.7 mt -101.36 113.52 37.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.883 -0.599 . . . . 6.78 109.667 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.529 HG12 ' HG2' ' B' ' 15' ' ' ARG . 64.2 mt -88.72 100.33 10.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.917 -0.583 . . . . 6.31 110.005 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 108' ' ' CYS . . . . . 0.57 ' HA ' ' HA ' ' B' ' 92' ' ' SER . 54.0 m -88.38 106.87 18.53 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.106 0.479 . . . . 5.31 111.204 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 109' ' ' THR . . . . . 0.629 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 0.4 OUTLIER -81.39 87.03 6.19 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.273 -0.64 . . . . 5.48 109.273 178.576 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 110' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -69.61 141.47 53.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.692 -0.686 . . . . 6.9 110.6 -178.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 2.6 m -149.47 113.53 5.16 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.107 -0.331 . . . . 8.61 110.107 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 112' ' ' ASN . . . . . 0.738 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 17.7 t-20 -70.08 133.38 47.11 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.195 0.521 . . . . 11.84 110.987 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 113' ' ' VAL . . . . . 0.476 HG12 ' HG3' ' B' ' 114' ' ' LYS . 66.2 t -113.6 -51.25 5.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.557 -0.747 . . . . 11.77 109.359 179.138 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 114' ' ' LYS . . . . . 0.684 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 61.0 mtpt . . . . . 0 C--O 1.246 0.871 0 CA-C-O 118.369 -0.825 . . . . 12.68 109.609 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 56.7 m . . . . . 0 N--CA 1.475 0.784 0 CA-C-O 120.882 0.373 . . . . 15.6 110.432 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -86.13 117.62 69.02 Favored Pre-proline 0 C--N 1.323 -0.553 0 N-CA-C 109.836 -0.431 . . . . 15.08 109.836 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.8 154.49 58.83 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.598 2.198 . . . . 13.43 112.164 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.846 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.7 OUTLIER -79.92 56.09 2.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.493 0.663 . . . . 11.09 110.516 179.593 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.513 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 15.6 tt0 -157.12 117.78 3.58 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.058 -0.974 . . . . 10.59 108.939 -178.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.868 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 35.7 p90 -140.77 162.14 36.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.365 0.602 . . . . 8.93 112.191 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.453 HG23 HG23 ' A' ' 107' ' ' ILE . 42.8 mm -93.99 124.93 46.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.467 -0.788 . . . . 8.66 110.802 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.586 ' HB3' ' HE1' ' A' ' 22' ' ' PHE . 2.4 m -115.14 105.77 13.31 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.27 -0.423 . . . . 6.11 110.934 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -89.97 112.58 24.03 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.278 -0.638 . . . . 9.09 109.278 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.2 p80 -139.22 159.9 41.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.474 0.178 . . . . 9.79 110.991 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -77.98 174.9 10.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.443 -0.344 . . . . 12.69 110.226 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 14.9 pt -57.32 -27.92 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 N-CA-C 113.236 0.828 . . . . 13.58 113.236 -178.555 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -80.44 -17.91 50.33 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.107 0.48 . . . . 13.85 111.453 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 110.11 0.1 29.94 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.506 -0.854 . . . . 9.38 112.793 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ILE . . . . . 0.482 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 30.9 mm -72.73 118.42 17.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.719 -0.474 . . . . 10.74 109.719 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.586 ' HE1' ' HB3' ' A' ' 14' ' ' SER . 90.1 m-85 -72.07 124.91 25.96 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.059 0.457 . . . . 9.73 111.924 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -97.39 -29.2 13.64 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.365 -0.834 . . . . 7.74 110.078 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -158.27 125.54 5.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.714 -0.676 . . . . 6.92 110.01 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.482 HG21 ' HB2' ' A' ' 40' ' ' LEU . 9.5 t -118.96 134.82 61.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.407 -0.36 . . . . 6.02 111.006 -179.376 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.868 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 9.7 t70 -66.26 139.41 58.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.011 -0.54 . . . . 7.31 109.771 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -62.77 -14.23 42.51 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.332 0.493 . . . . 11.67 112.332 -179.137 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.429 ' HB2' ' HB3' ' A' ' 12' ' ' PHE . 79.7 mtm180 -69.04 -10.97 60.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.675 0.274 . . . . 11.91 111.282 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 27.8 p -60.6 -31.98 71.12 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.765 0.317 . . . . 12.99 110.515 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.427 ' O ' ' HA2' ' A' ' 34' ' ' GLY . 42.5 t -62.04 -35.3 67.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.77 -0.65 . . . . 16.15 111.296 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -91.25 -8.1 49.35 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.825 0.345 . . . . 15.07 111.69 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.694 ' HA ' HG22 ' A' ' 10' ' ' THR . 24.7 m -97.13 -55.23 2.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.856 0.36 . . . . 14.9 111.322 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.419 HG12 HD21 ' A' ' 86' ' ' LEU . 2.9 m -117.18 -13.61 10.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.405 -0.361 . . . . 13.84 111.741 -179.452 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.427 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 92.11 -15.15 62.67 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.603 -0.808 . . . . 13.85 112.524 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -75.01 139.01 42.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.564 0.221 . . . . 18.28 110.662 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.536 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 11.5 mm100 -80.59 149.8 68.8 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.394 -0.595 . . . . 15.48 109.394 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.592 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 51.2 Cg_exo -54.8 -37.41 92.27 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.411 2.074 . . . . 11.63 112.388 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.494 ' HA ' HD12 ' A' ' 41' ' ' LEU . 15.5 mp0 -69.77 -19.07 63.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.125 -0.489 . . . . 13.31 111.347 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.536 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 47.1 mt-10 -82.11 -14.33 55.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.971 0.415 . . . . 17.34 110.37 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.482 ' HB2' HG21 ' A' ' 25' ' ' VAL . 3.2 mm? -101.07 -27.31 13.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.866 -0.606 . . . . 13.25 110.301 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 95.1 mt -60.64 125.54 24.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.947 -0.569 . . . . 12.99 110.673 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 81.54 2.71 90.62 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.872 -0.68 . . . . 13.39 112.366 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.725 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 9.1 mmpt? -111.69 160.49 17.22 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.776 0.322 . . . . 16.87 110.647 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.68 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 16.0 m120 -96.48 135.58 38.16 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.041 -0.527 . . . . 12.5 109.698 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.555 HG13 ' HE1' ' A' ' 78' ' ' PHE . 10.6 tt -59.53 -26.09 33.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.18 0.514 . . . . 11.72 110.947 179.176 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.521 HG12 ' HB3' ' A' ' 44' ' ' ASN . 9.9 p -69.93 -22.18 24.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 115.716 -0.675 . . . . 12.89 111.424 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.68 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.5 mt-10 -70.05 -36.06 74.72 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.303 0.573 . . . . 16.53 110.731 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -101.69 34.74 2.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.769 -0.65 . . . . 15.34 110.443 -179.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 36.0 t -120.9 150.25 41.36 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.623 -0.717 . . . . 11.97 110.296 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' HIS . . . . . 0.413 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 7.9 t-160 -58.64 126.23 79.16 Favored Pre-proline 0 C--N 1.329 -0.312 0 N-CA-C 109.147 -0.686 . . . . 14.67 109.147 178.616 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -44.51 -48.97 9.61 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 123.348 2.699 . . . . 15.15 114.17 -178.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -73.75 -4.5 34.98 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.36 0.504 . . . . 16.47 112.36 -179.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.429 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 9.3 m-20 -115.37 -2.13 12.7 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.947 0.403 . . . . 13.16 111.133 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -63.11 -41.0 99.25 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.92 -0.582 . . . . 15.83 111.156 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.1 tp60 -64.61 -43.33 94.09 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.732 -0.469 . . . . 13.94 109.732 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.8 tp -59.73 -39.34 84.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.756 -0.656 . . . . 12.11 110.139 178.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.469 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.4 OUTLIER -62.91 -51.31 67.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.842 -0.617 . . . . 9.71 110.402 179.421 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.425 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 62.0 ttt180 -63.25 -43.13 98.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.074 -0.512 . . . . 11.06 110.756 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.461 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 33.6 t70 -59.02 -47.98 83.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.273 -0.421 . . . . 9.71 110.475 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.6 m -62.63 -34.96 78.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.967 -0.56 . . . . 9.52 110.524 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.606 ' O ' HG12 ' A' ' 64' ' ' VAL . 3.5 m-30 -63.96 -42.18 97.35 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.872 -0.418 . . . . 11.4 109.872 178.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 58' ' ' ARG . 82.4 mm-40 -67.98 -32.73 73.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.305 -0.407 . . . . 10.04 110.12 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 59' ' ' ASP . 39.2 mt-30 -70.73 -38.52 73.58 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.095 -0.502 . . . . 10.6 111.035 179.647 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.606 HG12 ' O ' ' A' ' 61' ' ' PHE . 2.7 p -67.42 -25.84 34.38 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 CA-C-O 120.857 0.36 . . . . 10.62 110.519 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' ' 61' ' ' PHE . 89.7 t -74.94 -21.81 16.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 N-CA-C 108.89 -0.782 . . . . 12.41 108.89 178.172 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.7 mtpt -86.07 -32.62 21.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.393 -0.821 . . . . 16.25 109.489 178.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.833 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 82.0 mt -69.06 -54.87 12.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.586 -0.733 . . . . 12.66 110.538 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 95.1 mttt 59.67 97.59 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.977 0.798 . . . . 14.83 112.325 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.28 -12.38 68.11 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.647 -0.787 . . . . 9.8 112.235 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.833 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 6.7 tp-100 -99.2 137.22 38.02 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.322 -0.621 . . . . 9.59 109.322 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.473 ' HB ' ' HZ ' ' B' ' 24' ' ' PHE . 3.9 p -88.88 121.93 39.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.3 0.572 . . . . 8.1 110.792 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 41.0 tp -109.45 115.49 30.05 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.699 -0.682 . . . . 7.8 109.734 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.3 m -92.46 104.17 16.52 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.113 -0.494 . . . . 7.59 111.031 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.445 HG13 ' HB ' ' A' ' 90' ' ' THR . 2.4 p -96.98 125.29 50.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.017 -0.538 . . . . 7.84 109.803 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 18.5 ttt -100.98 115.43 30.46 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.995 0.426 . . . . 9.35 111.025 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.429 ' HB2' ' HB3' ' A' ' 53' ' ' ASP . 40.6 p90 -146.28 -172.69 4.0 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.478 -0.783 . . . . 9.66 109.116 179.367 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.66 ' HB3' ' HB3' ' A' ' 85' ' ' TRP . 55.9 mtm180 -108.97 118.27 36.36 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.164 0.507 . . . . 13.1 110.833 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.555 ' HE1' HG13 ' A' ' 45' ' ' ILE . 18.2 t80 -96.71 149.63 21.59 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.4 -0.818 . . . . 9.28 110.407 -179.18 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.614 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 17.1 ttt180 -87.0 121.56 29.64 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.163 -0.471 . . . . 10.87 111.133 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.443 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 60.4 p -88.25 178.63 6.55 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.156 -0.474 . . . . 10.77 110.201 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -70.62 -13.53 62.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.272 0.558 . . . . 12.66 109.934 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -89.97 2.56 54.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.532 -0.758 . . . . 14.42 109.624 179.34 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 67.34 31.98 6.16 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.415 -0.811 . . . . 12.69 111.046 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.53 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 4.1 pt-20 -108.09 171.47 7.39 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.326 -0.62 . . . . 10.85 109.326 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' TRP . . . . . 0.66 ' HB3' ' HB3' ' A' ' 77' ' ' ARG . 23.7 m95 -120.41 98.57 6.11 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.079 -0.341 . . . . 11.2 110.079 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' A' ' 77' ' ' ARG . 1.1 pp -96.8 151.93 19.17 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.334 -0.393 . . . . 11.12 110.886 -179.435 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.533 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 95.5 m95 -73.93 116.54 14.67 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.257 0.551 . . . . 10.28 110.66 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 36.2 tpp -116.54 131.76 56.86 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.397 -0.82 . . . . 9.32 110.79 -179.21 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.412 ' HB3' ' HB ' ' A' ' 111' ' ' THR . 5.2 ttp180 -100.87 70.14 1.37 Allowed 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.326 -0.99 . . . . 10.66 108.326 178.331 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.445 ' HB ' HG13 ' A' ' 74' ' ' VAL . 41.7 m -60.78 107.34 0.68 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.58 -0.736 . . . . 9.37 112.27 -178.328 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' SER . . . . . 0.493 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 0.7 OUTLIER -86.52 88.92 7.74 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.11 -0.95 . . . . 8.27 109.719 179.407 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 18.7 m -77.92 126.43 30.83 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.135 -0.484 . . . . 8.65 111.369 -179.022 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -131.12 117.23 18.79 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.864 -0.607 . . . . 11.56 109.887 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.93 118.73 16.23 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.298 -0.41 . . . . 10.16 110.729 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -91.86 119.8 31.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.018 0.437 . . . . 12.25 110.619 -179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.493 ' HG2' HG12 ' A' ' 103' ' ' ILE . 34.0 mt-30 -124.15 167.51 14.16 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.75 -0.659 . . . . 14.24 110.003 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.441 ' HB2' ' HD2' ' A' ' 99' ' ' TYR . 64.1 m-80 -115.89 172.87 3.36 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 109.381 -0.6 . . . . 13.83 109.381 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.418 ' CD ' ' HB3' ' A' ' 97' ' ' ASN . 6.8 Cg_exo -75.69 28.87 0.38 Allowed 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.522 2.148 . . . . 15.34 112.308 178.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' TYR . . . . . 0.441 ' HD2' ' HB2' ' A' ' 97' ' ' ASN . 62.4 m-85 -92.87 -160.6 0.76 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.325 -0.398 . . . . 16.89 110.818 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.2 m -83.26 65.19 8.15 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.613 0.598 . . . . 14.89 112.613 -178.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 41.0 t0 51.01 76.18 0.17 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.646 -0.707 . . . . 14.77 112.45 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.31 165.57 20.29 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.844 -0.617 . . . . 12.95 109.884 179.138 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.493 HG12 ' HG2' ' A' ' 96' ' ' GLN . 80.1 mt -136.86 120.83 23.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 110.218 -0.289 . . . . 11.11 110.218 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.406 ' H ' ' HG2' ' A' ' 104' ' ' GLU . 5.1 pt-20 -81.16 -44.55 17.71 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.614 -0.434 . . . . 11.65 110.469 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -165.46 178.18 6.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.481 -0.327 . . . . 10.3 110.52 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 40.8 mt -115.57 122.95 70.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.078 -0.51 . . . . 10.29 110.224 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.682 HG21 HH22 ' B' ' 15' ' ' ARG . 61.8 mt -93.21 114.84 30.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.13 -0.486 . . . . 8.99 109.863 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 79.5 m -108.77 119.47 39.62 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.119 0.485 . . . . 9.83 111.423 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.493 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 2.6 m -88.16 101.01 13.4 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.643 -0.873 . . . . 10.84 108.643 178.334 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ASN . . . . . 0.513 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 42.6 m-20 -79.23 104.32 9.77 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.232 -0.44 . . . . 11.26 111.547 -178.375 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' THR . . . . . 0.412 ' HB ' ' HB3' ' A' ' 89' ' ' ARG . 5.6 m -104.18 118.83 37.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.623 -0.717 . . . . 11.22 110.515 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ASN . . . . . 0.846 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 3.5 t-20 -80.82 117.9 21.87 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.015 0.435 . . . . 12.78 110.299 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 18.9 t -97.77 -54.62 6.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.864 -0.607 . . . . 14.64 109.776 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 48.9 mtpt . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.224 -0.893 . . . . 16.02 109.52 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 71.5 m . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 110.108 -0.33 . . . . 7.49 110.108 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 8' ' ' GLN . . . . . 0.938 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 93.0 mm-40 -112.85 150.42 42.79 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 116.529 -0.305 . . . . 7.12 110.828 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.2 174.32 12.67 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 123.015 2.476 . . . . 6.18 113.131 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' THR . . . . . 0.508 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.0 OUTLIER -83.56 58.51 4.61 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 116.001 -0.545 . . . . 5.81 111.536 -179.86 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.589 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 7.7 pt-20 -166.42 136.42 3.24 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.173 -0.677 . . . . 5.85 109.173 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 12' ' ' PHE . . . . . 0.41 ' HB3' ' HB2' ' B' ' 28' ' ' ARG . 39.6 p90 -146.12 156.61 43.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.331 0.586 . . . . 6.08 112.005 -179.047 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.503 HG22 ' HG3' ' B' ' 15' ' ' ARG . 28.0 mm -86.08 119.13 33.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.359 -0.837 . . . . 5.57 110.264 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.797 ' HB3' ' HE2' ' B' ' 22' ' ' PHE . 1.2 m -107.13 92.12 3.95 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.963 -0.562 . . . . 5.3 110.507 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 15' ' ' ARG . . . . . 0.682 HH22 HG21 ' A' ' 107' ' ' ILE . 8.5 mtp180 -85.3 102.06 13.06 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.308 -0.627 . . . . 8.97 109.308 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 16' ' ' HIS . . . . . 0.419 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 29.9 p80 -131.43 164.07 26.54 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.236 -0.438 . . . . 8.31 110.872 -179.005 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -78.2 179.18 7.05 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.318 -0.401 . . . . 10.83 110.621 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 27.3 pt -56.88 -33.32 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 113.252 0.834 . . . . 8.89 113.252 -178.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -76.13 -21.94 56.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.088 0.471 . . . . 11.92 111.382 -179.025 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 114.05 -4.19 23.97 Favored Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 120.665 -0.779 . . . . 8.57 112.327 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' ILE . . . . . 0.43 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 38.7 mm -67.15 114.26 3.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.939 -0.393 . . . . 10.87 109.939 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 22' ' ' PHE . . . . . 0.797 ' HE2' ' HB3' ' B' ' 14' ' ' SER . 97.3 m-85 -68.48 126.32 29.27 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.168 -0.469 . . . . 8.23 111.242 -179.505 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 3.9 m -100.01 -37.88 8.81 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.61 -0.723 . . . . 7.91 110.171 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' PHE . . . . . 0.486 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 30.1 t80 -147.77 123.41 10.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.675 -0.693 . . . . 7.89 109.496 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 25' ' ' VAL . . . . . 0.536 HG21 ' HB2' ' B' ' 40' ' ' LEU . 14.5 t -120.46 138.87 49.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 120.884 0.374 . . . . 6.1 111.074 -179.005 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 26' ' ' ASP . . . . . 0.403 ' CG ' ' HE ' ' B' ' 28' ' ' ARG . 10.7 t70 -71.15 153.55 42.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.852 -0.613 . . . . 7.15 109.971 179.191 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 34.9 m170 -70.16 -10.82 60.0 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.806 0.299 . . . . 8.97 111.806 -178.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' ARG . . . . . 0.938 ' HG2' ' HB3' ' B' ' 8' ' ' GLN . 72.7 mtm180 -68.08 -11.45 59.07 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 111.995 0.368 . . . . 9.76 111.995 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 20.2 p -58.32 -38.76 77.77 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 111.861 0.319 . . . . 11.56 111.861 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 4.1 t -66.39 -31.96 55.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.338 -0.392 . . . . 13.64 111.072 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.63 -10.82 56.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.904 0.383 . . . . 12.9 111.458 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 32' ' ' THR . . . . . 0.455 ' HA ' HG22 ' B' ' 10' ' ' THR . 14.8 m -99.74 -59.83 1.64 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.068 -0.515 . . . . 12.13 111.978 -179.252 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 33' ' ' VAL . . . . . 0.726 HG12 HD21 ' B' ' 86' ' ' LEU . 3.3 m -116.57 -5.48 11.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 111.824 0.305 . . . . 13.87 111.824 -179.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.22 0.94 89.61 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.651 -0.785 . . . . 13.79 112.285 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 35' ' ' TYR . . . . . 0.45 ' HB2' HG23 ' B' ' 33' ' ' VAL . 2.4 m-85 -80.1 137.0 36.66 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.644 0.259 . . . . 15.38 111.054 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 36' ' ' GLN . . . . . 0.57 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 75.8 mm-40 -79.4 150.01 73.03 Favored Pre-proline 0 C--N 1.322 -0.63 0 N-CA-C 108.667 -0.864 . . . . 13.78 108.667 178.256 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 37' ' ' PRO . . . . . 0.528 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 51.6 Cg_exo -53.18 -38.5 81.26 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.613 2.208 . . . . 14.71 112.303 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -67.79 -22.2 65.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.965 -0.561 . . . . 17.54 111.408 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 39' ' ' GLU . . . . . 0.57 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 36.4 mt-10 -73.82 -23.12 59.62 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.655 0.264 . . . . 14.24 110.951 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.536 ' HB2' HG21 ' B' ' 25' ' ' VAL . 1.7 mm? -93.17 -34.92 13.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.895 0.379 . . . . 14.03 110.625 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 41' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 81.7 mt -58.31 119.07 6.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 13.62 111.259 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.33 5.01 76.55 Favored Glycine 0 N--CA 1.454 -0.163 0 C-N-CA 121.002 -0.618 . . . . 11.62 112.636 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.457 ' HA ' ' NZ ' ' B' ' 43' ' ' LYS . 0.5 OUTLIER -119.04 159.53 23.71 Favored 'General case' 0 C--N 1.321 -0.664 0 O-C-N 122.586 -0.361 . . . . 13.82 110.353 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 44' ' ' ASN . . . . . 0.672 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 12.5 m120 -95.46 140.15 30.73 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.35 -0.611 . . . . 10.16 109.35 178.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 20.8 tt -61.28 -24.63 33.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.305 0.574 . . . . 9.62 110.542 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 46' ' ' VAL . . . . . 0.41 HG12 ' HB3' ' B' ' 44' ' ' ASN . 9.0 p -71.84 -22.68 21.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.774 -0.648 . . . . 11.5 111.183 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 47' ' ' GLU . . . . . 0.672 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 40.5 mt-10 -67.07 -34.6 78.0 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.164 0.507 . . . . 11.89 110.481 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -104.08 24.67 11.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.729 -0.669 . . . . 13.6 110.433 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 49.0 t -109.19 148.78 30.38 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.832 -0.622 . . . . 10.81 110.41 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 8.1 t-160 -64.9 126.72 91.69 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.713 -0.676 . . . . 11.49 109.236 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -43.24 -48.8 7.81 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 123.534 2.823 . . . . 11.35 113.779 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -70.53 -7.91 47.34 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.135 0.42 . . . . 9.28 112.135 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 53' ' ' ASP . . . . . 0.637 ' HB3' ' HB2' ' B' ' 76' ' ' PHE . 16.5 m-20 -117.57 -1.17 11.71 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.951 0.405 . . . . 7.52 110.706 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -65.14 -49.22 70.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.969 -0.559 . . . . 6.57 111.659 -178.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -64.96 -34.86 79.43 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.504 -0.554 . . . . 6.58 109.504 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.3 tp -58.09 -42.92 86.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.961 -0.563 . . . . 4.6 109.777 178.386 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 57' ' ' LEU . . . . . 0.454 HD23 ' HA ' ' B' ' 57' ' ' LEU . 0.9 OUTLIER -69.16 -48.95 60.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.94 -0.573 . . . . 6.4 110.265 179.007 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 58' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' B' ' 58' ' ' ARG . 28.5 ttt180 -57.45 -46.32 83.75 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.875 -0.602 . . . . 8.18 111.244 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 59' ' ' ASP . . . . . 0.4 ' O ' ' HG3' ' B' ' 63' ' ' GLN . 12.7 t70 -61.0 -41.21 96.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.227 -0.442 . . . . 6.07 110.744 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 44.6 m -64.15 -35.54 81.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.479 . . . . 5.59 110.486 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 61' ' ' PHE . . . . . 0.508 ' O ' HG12 ' B' ' 64' ' ' VAL . 9.7 m-85 -64.18 -40.85 96.97 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.475 -0.565 . . . . 7.73 109.475 178.733 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 78.4 mm-40 -63.15 -38.83 92.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.96 -0.564 . . . . 6.89 109.969 178.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 63' ' ' GLN . . . . . 0.513 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 68.6 mt-30 -67.14 -47.62 70.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.688 -0.687 . . . . 9.4 111.132 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 64' ' ' VAL . . . . . 0.508 HG12 ' O ' ' B' ' 61' ' ' PHE . 4.1 p -62.24 -30.99 50.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-N 116.387 -0.37 . . . . 7.57 111.864 -178.595 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 65' ' ' VAL . . . . . 0.478 HG23 ' O ' ' B' ' 61' ' ' PHE . 70.9 t -68.75 -37.65 77.78 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 109.516 -0.55 . . . . 7.43 109.516 178.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -71.57 -32.72 68.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.786 -0.643 . . . . 10.21 110.165 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 67' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' B' ' 63' ' ' GLN . 94.0 mt -67.33 -54.13 23.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.854 -0.612 . . . . 7.2 110.365 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 23.5 mttt 63.26 113.37 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.439 -0.8 . . . . 7.58 112.008 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 77.26 19.81 76.23 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.798 -0.715 . . . . 5.57 112.17 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -126.01 153.5 44.3 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.937 -0.394 . . . . 5.43 109.937 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 71' ' ' VAL . . . . . 0.519 ' CG2' ' HB3' ' B' ' 91' ' ' SER . 3.3 p -110.96 116.37 52.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-O 121.299 0.571 . . . . 5.65 110.518 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 18.7 tp -107.95 116.56 32.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.701 -0.681 . . . . 4.51 110.306 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 73' ' ' SER . . . . . 0.547 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 7.6 m -90.36 115.7 27.75 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.175 -0.466 . . . . 6.35 110.995 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 p -113.83 126.96 71.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 116.096 -0.502 . . . . 4.34 110.107 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 24.7 ttt -94.83 113.79 25.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.167 0.508 . . . . 5.42 110.563 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.637 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 48.0 p90 -137.9 -174.58 3.82 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.63 -0.714 . . . . 3.54 109.397 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 77' ' ' ARG . . . . . . . . . . . . . 9.3 mtm180 -108.3 115.19 29.66 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.99 0.424 . . . . 6.8 110.11 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.552 ' HD2' HG11 ' B' ' 33' ' ' VAL . 28.0 t80 -100.52 148.46 24.77 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.656 -0.702 . . . . 5.79 110.282 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 79' ' ' ARG . . . . . 0.535 ' HA ' ' O ' ' B' ' 84' ' ' GLU . 20.2 ttp180 -85.77 133.47 33.99 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.142 -0.481 . . . . 11.08 110.725 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 80' ' ' SER . . . . . 0.476 ' HA ' ' HB ' ' B' ' 33' ' ' VAL . 96.6 p -93.14 179.48 5.41 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.522 -0.547 . . . . 7.47 109.522 178.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 47.3 tptt -67.89 -14.76 63.22 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.607 0.718 . . . . 12.24 109.53 178.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 40.0 m-20 -89.02 2.52 53.89 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.151 -0.931 . . . . 9.25 109.685 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 66.49 25.08 10.22 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 115.305 -0.862 . . . . 8.3 111.522 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 84' ' ' GLU . . . . . 0.535 ' O ' ' HA ' ' B' ' 79' ' ' ARG . 1.9 pt-20 -104.29 167.15 9.94 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.228 -0.656 . . . . 6.78 109.228 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 85' ' ' TRP . . . . . 0.518 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 49.3 m95 -109.04 118.82 37.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.049 0.452 . . . . 7.89 110.69 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 86' ' ' LEU . . . . . 0.726 HD21 HG12 ' B' ' 33' ' ' VAL . 2.1 pp -116.02 150.38 37.33 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.004 -0.544 . . . . 6.97 109.986 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 87' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -72.73 122.19 21.09 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.871 -0.418 . . . . 8.55 109.871 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 15.0 tpp -128.35 126.6 41.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.135 -0.484 . . . . 4.46 110.96 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 30.3 ttp180 -100.19 87.58 3.49 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.292 -1.003 . . . . 6.87 108.292 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 90' ' ' THR . . . . . 0.457 HG23 ' HB3' ' B' ' 108' ' ' CYS . 28.0 m -80.66 112.87 18.42 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.672 -0.694 . . . . 6.18 112.309 -178.305 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 91' ' ' SER . . . . . 0.67 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 44.5 m -88.76 90.67 8.51 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.584 -0.734 . . . . 6.3 109.179 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 92' ' ' SER . . . . . 0.541 ' HA ' ' HA ' ' B' ' 108' ' ' CYS . 15.6 m -78.77 122.37 25.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.235 -0.438 . . . . 6.65 111.502 -178.546 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -118.17 121.37 40.33 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.284 -0.417 . . . . 6.45 110.562 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 94' ' ' THR . . . . . 0.437 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.6 OUTLIER -86.19 100.72 12.43 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.426 -0.352 . . . . 9.17 110.189 179.051 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -76.71 126.28 30.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.988 0.423 . . . . 8.33 111.084 -179.403 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -94.84 116.33 28.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.867 -0.606 . . . . 10.53 109.731 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 97' ' ' ASN . . . . . 0.402 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 51.5 t30 -65.46 126.75 92.11 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 109.544 -0.539 . . . . 8.43 109.544 179.498 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 98' ' ' PRO . . . . . 0.402 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 58.2 Cg_endo -71.29 42.72 0.46 Allowed 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 123.076 2.518 . . . . 9.16 113.693 -178.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -118.56 -61.2 1.69 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.407 -0.59 . . . . 11.34 109.407 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -135.14 22.47 3.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.638 -0.71 . . . . 7.75 109.868 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 4.3 t70 63.42 24.59 14.21 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.549 -0.75 . . . . 9.08 110.727 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -84.93 143.03 29.25 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.995 0.426 . . . . 7.71 110.462 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 67.1 mt -79.72 109.43 14.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.295 -0.412 . . . . 8.04 109.896 179.469 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -71.6 -41.93 68.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.422 -0.353 . . . . 8.81 110.647 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -169.89 168.63 8.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.296 -0.411 . . . . 7.4 109.911 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 22.1 mt -103.21 118.89 50.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.106 -0.497 . . . . 6.78 110.036 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 46.3 mt -88.62 93.19 4.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.74 -0.664 . . . . 6.31 109.912 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 108' ' ' CYS . . . . . 0.541 ' HA ' ' HA ' ' B' ' 92' ' ' SER . 67.1 m -87.75 116.79 26.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.183 -0.462 . . . . 5.31 111.295 -179.658 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 109' ' ' THR . . . . . 0.67 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 1.2 m -88.69 83.38 6.73 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.149 -0.686 . . . . 5.48 109.149 178.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 110' ' ' ASN . . . . . 0.525 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 6.1 m-20 -67.24 103.08 1.16 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.707 -0.679 . . . . 6.9 111.14 -178.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 1.1 m -110.85 114.39 27.7 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.415 -0.357 . . . . 8.61 110.332 179.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 112' ' ' ASN . . . . . 0.508 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 3.0 t30 -68.65 135.32 51.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.02 0.438 . . . . 11.84 110.772 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 9.4 t -104.29 -59.06 3.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.868 -0.606 . . . . 11.77 109.627 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 24.3 mtpt . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.207 -0.902 . . . . 12.68 109.945 -179.858 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.554 ' HA ' HG11 ' B' ' 71' ' ' VAL . 16.5 mt-30 . . . . . 0 C--O 1.235 0.306 0 CA-C-O 120.647 0.26 . . . . 15.08 110.728 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -72.87 159.8 47.44 Favored 'Trans proline' 0 C--O 1.234 0.292 0 C-N-CA 122.859 2.373 . . . . 13.43 112.013 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.511 HG22 HG23 ' A' ' 32' ' ' THR . 0.1 OUTLIER -83.14 52.04 2.1 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.333 0.587 . . . . 11.09 111.106 179.92 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.667 ' HB2' HG23 ' A' ' 111' ' ' THR . 37.6 tt0 -147.09 136.93 23.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.446 -0.797 . . . . 10.59 108.964 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.84 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 42.5 p90 -151.75 154.16 35.72 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.071 0.463 . . . . 8.93 111.489 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.432 HD13 ' HA ' ' A' ' 13' ' ' ILE . 21.1 mm -88.64 127.31 41.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.061 -0.518 . . . . 8.66 110.842 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.901 ' HB3' ' HE2' ' A' ' 22' ' ' PHE . 1.4 m -110.23 97.39 6.88 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.831 -0.622 . . . . 6.11 110.791 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 11.2 mtt180 -86.24 110.43 19.61 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.545 -0.539 . . . . 9.09 109.545 179.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 33.3 p80 -147.03 156.2 42.83 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.629 -0.259 . . . . 9.79 110.558 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -76.62 -175.68 3.46 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.628 0.252 . . . . 12.69 110.926 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 26.9 pt -62.31 -25.44 37.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 N-CA-C 112.873 0.694 . . . . 13.58 112.873 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -76.5 -30.53 57.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.214 0.53 . . . . 13.85 110.669 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 118.02 -6.38 15.4 Favored Glycine 0 N--CA 1.444 -0.814 0 N-CA-C 111.225 -0.75 . . . . 9.38 111.225 -179.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.444 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 34.6 mm -68.69 117.84 11.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 O-C-N 123.973 0.455 . . . . 10.74 109.791 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.901 ' HE2' ' HB3' ' A' ' 14' ' ' SER . 87.7 m-85 -73.2 132.92 43.78 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.083 0.468 . . . . 9.73 112.081 -178.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.02 -27.37 12.17 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.3 -0.864 . . . . 7.74 110.278 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.434 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 31.2 t80 -154.33 121.63 5.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.701 -0.681 . . . . 6.92 109.516 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.611 ' HB ' ' HB3' ' A' ' 37' ' ' PRO . 4.8 t -110.39 146.36 15.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.033 0.444 . . . . 6.02 111.236 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.84 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 6.0 t70 -68.5 170.89 8.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.546 -0.752 . . . . 7.31 110.459 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -94.27 -21.43 19.02 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.11 0.481 . . . . 11.67 110.077 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 77.0 mtm180 -78.92 0.1 28.73 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.866 -0.606 . . . . 11.91 111.89 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 28.2 p -64.96 -33.51 76.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.972 0.415 . . . . 12.99 110.641 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.502 ' O ' ' HA2' ' A' ' 34' ' ' GLY . 2.9 t -69.59 -27.08 32.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.933 -0.576 . . . . 16.15 110.726 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.92 -24.38 26.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.105 0.479 . . . . 15.07 110.278 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.511 HG23 HG22 ' A' ' 10' ' ' THR . 25.2 m -85.01 -61.92 1.66 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.753 -0.658 . . . . 14.9 111.699 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.612 HG23 ' H ' ' A' ' 35' ' ' TYR . 15.6 m -111.35 -15.22 10.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 111.941 0.349 . . . . 13.84 111.941 -179.245 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.502 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 89.39 0.11 80.19 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.423 -0.894 . . . . 13.85 112.325 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.612 ' H ' HG23 ' A' ' 33' ' ' VAL . 0.7 OUTLIER -83.46 135.04 34.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.653 0.263 . . . . 18.28 110.458 179.882 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.669 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 79.0 mm-40 -75.41 146.71 81.49 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 116.054 -0.521 . . . . 15.48 110.059 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.611 ' HB3' ' HB ' ' A' ' 25' ' ' VAL . 41.6 Cg_exo -57.12 -35.35 98.89 Favored 'Trans proline' 0 CA--C 1.527 0.166 0 C-N-CA 122.588 2.192 . . . . 11.63 112.185 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.436 ' HA ' HD12 ' A' ' 41' ' ' LEU . 22.4 mp0 -69.25 -15.93 63.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.96 -0.564 . . . . 13.31 111.493 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.669 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 34.8 mt-10 -81.09 -32.48 33.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.786 0.327 . . . . 17.34 111.013 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.565 ' HB2' HG21 ' A' ' 25' ' ' VAL . 2.9 mm? -82.1 -24.66 35.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.121 -0.49 . . . . 13.25 110.915 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 89.7 mt -62.69 116.69 5.42 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.136 -0.484 . . . . 12.99 111.402 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.32 -4.26 85.34 Favored Glycine 0 N--CA 1.451 -0.339 0 CA-C-N 115.879 -0.601 . . . . 13.39 112.694 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.466 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 6.1 mmpt? -107.87 161.91 14.49 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.617 0.246 . . . . 16.87 110.457 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.762 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 15.1 m120 -95.66 139.02 32.51 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.544 -0.539 . . . . 12.5 109.544 179.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.58 HG13 ' HE1' ' A' ' 78' ' ' PHE . 9.1 tt -61.85 -30.37 48.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.016 0.436 . . . . 11.72 110.589 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.0 p -65.7 -22.03 30.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 116.183 -0.462 . . . . 12.89 111.254 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.762 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 41.1 mt-10 -73.83 -17.73 61.03 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.358 -0.383 . . . . 16.53 111.553 -179.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -117.97 24.53 10.96 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.17 0.51 . . . . 15.34 110.198 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 48.9 t -112.08 155.73 23.38 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.665 -0.698 . . . . 11.97 110.305 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.59 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 4.9 t-160 -56.92 122.33 51.93 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.842 -0.617 . . . . 14.67 109.408 178.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 99.2 Cg_exo -45.29 -49.06 10.7 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.456 2.77 . . . . 15.15 114.157 -178.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -75.77 0.93 16.22 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.291 0.478 . . . . 16.47 112.291 -179.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.59 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 26.4 m-20 -124.96 7.78 8.03 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.162 0.506 . . . . 13.16 110.159 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -66.35 -44.1 84.17 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.79 -0.641 . . . . 15.83 110.592 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.7 tp60 -62.58 -38.36 89.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.302 -0.408 . . . . 13.94 109.925 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.9 tp -57.48 -40.12 77.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.89 -0.595 . . . . 12.11 110.182 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.417 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.9 OUTLIER -69.59 -49.03 58.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.793 -0.639 . . . . 9.71 110.155 179.348 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.426 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 70.6 ttt180 -58.61 -48.61 80.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.986 -0.552 . . . . 11.06 111.392 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -56.56 -44.98 81.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.039 0.447 . . . . 9.71 110.807 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.3 m -70.28 -31.36 68.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.017 -0.538 . . . . 9.52 110.994 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.56 ' O ' HG12 ' A' ' 64' ' ' VAL . 1.4 m-30 -65.12 -49.99 67.79 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.048 -0.353 . . . . 11.4 110.048 178.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 58' ' ' ARG . 12.7 mm100 -64.8 -29.9 70.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.337 0.589 . . . . 10.04 109.572 179.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -66.27 -48.56 70.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.014 -0.993 . . . . 10.6 110.648 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.56 HG12 ' O ' ' A' ' 61' ' ' PHE . 4.3 p -64.74 -25.1 37.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-O 120.838 0.351 . . . . 10.62 110.87 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.615 ' HA ' HG21 ' A' ' 94' ' ' THR . 93.1 t -70.61 -40.39 77.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 108.954 -0.758 . . . . 12.41 108.954 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -72.97 -29.24 62.91 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.546 -0.752 . . . . 16.25 109.963 178.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.737 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 88.7 mt -70.13 -48.17 58.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.981 -0.554 . . . . 12.66 109.94 178.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 32.8 mttt 59.61 99.47 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.571 -0.741 . . . . 14.83 112.607 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.03 -26.27 13.75 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.674 -0.774 . . . . 9.8 112.886 178.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.737 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 7.9 tp-100 -79.11 113.12 16.98 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.744 0.307 . . . . 9.59 110.251 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 3.0 p -66.64 116.6 6.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.804 -0.634 . . . . 8.1 110.805 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 64.8 tp -111.88 108.15 17.42 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.696 -0.684 . . . . 7.8 110.381 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.561 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 1.2 m -87.45 109.33 19.51 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.961 -0.563 . . . . 7.59 110.95 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.8 p -102.34 132.93 47.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.766 -0.457 . . . . 7.84 109.766 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . 0.479 ' HG2' ' HE3' ' A' ' 87' ' ' TRP . 23.1 ttt -102.41 122.0 43.44 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.904 0.383 . . . . 9.35 111.07 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.518 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 47.8 p90 -148.89 -174.7 4.7 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.204 -0.453 . . . . 9.66 110.075 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.49 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 31.2 mtm180 -110.61 120.65 43.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.12 0.486 . . . . 13.1 110.297 178.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.58 ' HE1' HG13 ' A' ' 45' ' ' ILE . 15.9 t80 -101.0 153.51 19.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.311 -0.859 . . . . 9.28 110.143 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.53 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 42.7 ttt180 -90.01 124.0 34.38 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.13 -0.486 . . . . 10.87 110.636 179.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.42 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 59.5 p -85.84 -179.43 6.82 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.22 -0.446 . . . . 10.77 110.469 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -71.16 -14.45 62.28 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.516 0.674 . . . . 12.66 109.476 179.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.456 ' O ' ' HB2' ' A' ' 83' ' ' GLN . 87.9 m-20 -88.77 -1.79 58.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.435 -0.802 . . . . 14.42 109.74 179.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' A' ' 82' ' ' ASN . 2.9 mp0 72.54 22.62 3.28 Favored 'General case' 0 N--CA 1.465 0.277 0 O-C-N 123.902 0.751 . . . . 12.69 110.748 -179.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.482 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.0 pt-20 -97.68 170.41 9.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.823 -0.626 . . . . 10.85 109.515 179.264 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.53 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 51.5 m95 -116.72 110.75 18.85 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.86 0.362 . . . . 11.2 110.529 -179.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.49 ' O ' ' HA ' ' A' ' 77' ' ' ARG . 0.5 OUTLIER -108.74 150.17 27.98 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.09 -0.504 . . . . 11.12 110.581 -179.821 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.904 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 72.0 m95 -82.35 117.12 22.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.972 0.415 . . . . 10.28 110.394 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.419 ' SD ' ' HB3' ' A' ' 110' ' ' ASN . 9.2 ttp -126.04 138.59 53.73 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.055 -0.52 . . . . 9.32 110.602 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 33.1 ttp-105 -103.81 107.38 18.23 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.896 -0.779 . . . . 10.66 108.896 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.629 HG23 ' HB3' ' A' ' 108' ' ' CYS . 24.7 m -92.61 105.37 17.54 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.742 -0.663 . . . . 9.37 112.426 -178.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.784 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 64.0 m -82.28 87.21 6.57 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.525 -0.917 . . . . 8.27 108.525 177.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.493 ' HA ' ' HA ' ' A' ' 108' ' ' CYS . 32.8 m -74.98 125.23 28.46 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.059 -0.519 . . . . 8.65 111.739 -178.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -123.41 109.52 13.97 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.593 -0.73 . . . . 11.56 109.58 179.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.615 HG21 ' HA ' ' A' ' 65' ' ' VAL . 0.2 OUTLIER -72.11 123.41 22.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.424 -0.353 . . . . 10.16 110.483 179.922 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . 0.442 ' O ' ' HA ' ' A' ' 103' ' ' ILE . 23.0 t80 -92.48 113.21 25.43 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.929 0.395 . . . . 12.25 111.09 -179.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -92.62 132.21 37.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.855 -0.611 . . . . 14.24 110.487 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -85.29 138.62 36.4 Favored Pre-proline 0 C--N 1.319 -0.751 0 N-CA-C 109.752 -0.462 . . . . 13.83 109.752 178.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -64.2 -11.45 27.84 Favored 'Trans proline' 0 CA--C 1.531 0.362 0 C-N-CA 122.753 2.302 . . . . 15.34 114.053 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -62.98 -74.7 0.09 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.741 0.305 . . . . 16.89 110.998 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.3 m -127.08 24.52 6.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.579 -0.282 . . . . 14.89 110.966 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 28.7 t70 62.64 35.52 14.19 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.445 0.641 . . . . 14.77 110.615 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.1 139.47 30.94 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.406 -0.361 . . . . 12.95 110.382 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.442 ' HA ' ' O ' ' A' ' 95' ' ' PHE . 50.5 mt -83.32 106.97 14.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.209 -0.45 . . . . 11.11 109.967 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -73.2 -38.96 65.93 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.882 -0.327 . . . . 11.65 110.661 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.458 ' HE1' HG12 ' A' ' 107' ' ' ILE . 16.3 p90 -159.8 167.98 26.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.378 -0.374 . . . . 10.3 110.291 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 21.4 mt -110.18 120.63 61.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.969 -0.56 . . . . 10.29 110.138 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.606 HG21 HH22 ' B' ' 15' ' ' ARG . 15.7 mt -88.54 95.92 5.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.098 -0.501 . . . . 8.99 109.657 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.629 ' HB3' HG23 ' A' ' 90' ' ' THR . 96.3 m -91.07 116.32 28.7 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.086 -0.507 . . . . 9.83 111.936 -178.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.784 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 2.8 m -86.97 97.55 10.76 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.798 -0.815 . . . . 10.84 108.798 178.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.441 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 8.5 m-20 -86.14 104.82 16.07 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.143 -0.481 . . . . 11.26 111.908 -177.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.667 HG23 ' HB2' ' A' ' 11' ' ' GLU . 1.9 m -112.15 120.05 40.48 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.751 -0.462 . . . . 11.22 109.751 178.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . 0.482 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 2.6 t-20 -72.13 129.57 38.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.182 0.515 . . . . 12.78 111.072 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 3.5 t -103.45 -46.36 10.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.543 -0.753 . . . . 14.64 110.058 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.904 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 51.8 mtpt . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.44 -0.79 . . . . 16.02 109.74 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 56.1 m . . . . . 0 N--CA 1.479 1.02 0 CA-C-O 120.989 0.423 . . . . 7.49 110.373 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' GLN . . . . . 0.83 ' HG3' ' HA ' ' B' ' 28' ' ' ARG . 1.7 pm0 -108.15 150.6 40.67 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.234 -0.439 . . . . 7.12 109.887 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' B' ' 8' ' ' GLN . 11.3 Cg_exo -72.32 176.23 8.9 Favored 'Trans proline' 0 C--O 1.234 0.287 0 C-N-CA 122.842 2.361 . . . . 6.18 112.23 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . 0.746 HG22 ' HA ' ' B' ' 32' ' ' THR . 0.1 OUTLIER -82.59 50.5 1.67 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.272 -0.422 . . . . 5.81 111.684 -179.718 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.591 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -148.28 139.71 23.53 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.608 -0.515 . . . . 5.85 109.608 179.709 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' PHE . . . . . 0.738 ' HB3' ' HB2' ' B' ' 28' ' ' ARG . 33.8 p90 -155.28 153.37 30.49 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.018 0.437 . . . . 6.08 111.245 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.568 HG13 HG23 ' B' ' 107' ' ' ILE . 9.1 tt -88.03 113.26 24.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.651 -0.704 . . . . 5.57 110.47 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.443 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.7 OUTLIER -98.1 91.66 5.39 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.963 -0.562 . . . . 5.3 110.633 179.641 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . 0.62 ' HD3' ' HD2' ' B' ' 24' ' ' PHE . 8.7 mtp180 -82.56 111.22 18.35 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.884 -0.784 . . . . 8.97 108.884 179.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . 0.792 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 0.6 OUTLIER -146.51 172.5 13.46 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.367 -0.379 . . . . 8.31 111.425 -178.55 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -82.01 175.53 10.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.204 -0.453 . . . . 10.83 110.98 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 18.2 pt -58.82 -28.49 37.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 N-CA-C 113.039 0.755 . . . . 8.89 113.039 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -79.22 -10.37 59.8 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.882 0.372 . . . . 11.92 111.51 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 101.86 -8.35 55.99 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.452 -0.88 . . . . 8.57 112.987 179.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . 0.511 ' O ' ' HB2' ' B' ' 16' ' ' HIS . 24.8 mm -63.86 111.97 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 110.235 -0.283 . . . . 10.87 110.235 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . 0.792 ' HA ' ' HB3' ' B' ' 16' ' ' HIS . 97.4 m-85 -63.75 125.13 23.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.125 -0.489 . . . . 8.23 111.705 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 3.1 m -98.87 -44.47 6.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.537 -0.756 . . . . 7.91 110.605 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . 0.62 ' HD2' ' HD3' ' B' ' 15' ' ' ARG . 78.5 t80 -147.35 123.0 10.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.878 -0.601 . . . . 7.89 109.983 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 25.7 t -120.72 131.58 72.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.177 -0.465 . . . . 6.1 110.361 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -69.77 158.94 34.49 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.748 -0.464 . . . . 7.15 109.748 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -78.2 51.03 0.96 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.29 -0.414 . . . . 8.97 111.717 -178.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . 0.83 ' HA ' ' HG3' ' B' ' 8' ' ' GLN . 23.5 mtm180 -125.37 -16.98 5.74 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.816 0.341 . . . . 9.76 110.583 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 22.7 p -61.71 -27.01 68.41 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.167 -0.469 . . . . 11.56 111.656 -179.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.46 HG13 HE22 ' B' ' 36' ' ' GLN . 34.0 t -59.75 -39.52 79.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.052 -0.522 . . . . 13.64 111.19 -179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.9 -15.4 39.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.332 -0.395 . . . . 12.9 111.285 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . 0.746 ' HA ' HG22 ' B' ' 10' ' ' THR . 4.1 m -88.59 -53.27 4.73 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.254 0.464 . . . . 12.13 112.254 -178.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' VAL . . . . . 0.624 HG11 ' HD2' ' B' ' 78' ' ' PHE . 3.5 m -124.93 -13.07 5.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 112.455 0.539 . . . . 13.87 112.455 -178.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.1 -21.0 36.56 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.4 -0.905 . . . . 13.79 112.06 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -67.08 128.88 38.02 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.92 -0.4 . . . . 15.38 109.92 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . 0.566 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 27.5 mm-40 -74.99 149.79 85.46 Favored Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 109.62 -0.511 . . . . 13.78 109.62 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.596 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 61.9 Cg_exo -51.4 -42.27 55.72 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.748 2.298 . . . . 14.71 112.503 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 -62.17 -27.92 69.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.907 -0.588 . . . . 17.54 111.577 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.566 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 30.6 mt-10 -72.84 -33.22 66.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.385 -0.371 . . . . 14.24 110.449 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.414 ' HB3' ' CG ' ' B' ' 22' ' ' PHE . 1.1 mm? -80.83 -30.89 35.69 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.104 -0.498 . . . . 14.03 111.106 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 79.6 mt -60.03 119.19 7.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 13.62 110.937 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.05 5.61 73.03 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.976 -0.63 . . . . 11.62 112.448 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.492 ' O ' ' HA ' ' B' ' 21' ' ' ILE . 1.7 mmpt? -116.64 154.29 30.79 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.63 0.252 . . . . 13.82 110.747 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' ASN . . . . . 0.938 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 15.3 m120 -89.47 135.4 33.62 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.542 -0.54 . . . . 10.16 109.542 179.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . 0.45 HG21 ' HZ ' ' B' ' 61' ' ' PHE . 19.0 tt -61.96 -26.39 39.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.156 0.503 . . . . 9.62 110.634 179.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' VAL . . . . . 0.539 HG12 ' HB3' ' B' ' 44' ' ' ASN . 14.4 p -71.24 -22.1 22.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 CA-C-N 115.815 -0.629 . . . . 11.5 111.353 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . 0.938 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 35.9 mt-10 -69.69 -35.86 75.47 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.087 0.47 . . . . 11.89 110.652 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' PHE . . . . . 0.4 ' HE2' ' HB3' ' B' ' 43' ' ' LYS . 16.8 m-85 -97.11 8.78 43.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.883 -0.599 . . . . 13.6 109.915 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 44.4 t -93.27 147.79 22.6 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.861 -0.609 . . . . 10.81 110.858 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 5.4 t-160 -58.7 128.75 84.26 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.47 -0.787 . . . . 11.49 109.595 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -46.91 -51.09 9.77 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.186 2.591 . . . . 11.35 113.412 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -68.35 -5.26 17.84 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.311 0.486 . . . . 9.28 112.311 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -120.8 5.5 10.48 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.692 0.282 . . . . 7.52 111.185 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -64.07 -52.43 59.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.443 -0.344 . . . . 6.57 111.312 -179.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . 0.541 ' OE1' ' HD3' ' B' ' 58' ' ' ARG . 51.9 tp60 -63.95 -30.8 71.85 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.849 -0.426 . . . . 6.58 109.849 179.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.7 tp -59.17 -50.55 73.59 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.213 -0.662 . . . . 4.6 109.213 178.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.438 ' HA ' HD23 ' B' ' 57' ' ' LEU . 0.3 OUTLIER -67.56 -41.42 84.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.765 -0.652 . . . . 6.4 109.88 178.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . 0.541 ' HD3' ' OE1' ' B' ' 55' ' ' GLN . 38.5 ttt180 -55.21 -53.46 55.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.484 -0.78 . . . . 8.18 111.358 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . 0.458 ' O ' ' HG3' ' B' ' 63' ' ' GLN . 22.3 t70 -62.71 -37.81 87.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.468 -0.333 . . . . 6.07 110.453 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 50.9 m -61.67 -35.56 78.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 5.59 110.58 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 61' ' ' PHE . . . . . 0.544 ' O ' HG12 ' B' ' 64' ' ' VAL . 8.1 m-85 -63.59 -43.31 97.34 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 121.042 0.449 . . . . 7.73 109.901 178.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -68.47 -34.95 76.83 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.475 -0.565 . . . . 6.89 109.475 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' B' ' 59' ' ' ASP . 52.9 mt-30 -61.67 -47.53 84.94 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.702 -0.681 . . . . 9.4 110.968 179.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.544 HG12 ' O ' ' B' ' 61' ' ' PHE . 4.0 p -65.45 -29.82 48.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.402 -0.363 . . . . 7.57 111.216 -179.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . 0.505 HG23 ' O ' ' B' ' 61' ' ' PHE . 72.7 t -69.54 -37.51 74.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 109.455 -0.572 . . . . 7.43 109.455 178.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -72.0 -27.28 62.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.663 -0.699 . . . . 10.21 110.081 178.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.484 ' HB3' ' HB2' ' B' ' 70' ' ' GLN . 52.2 mt -73.08 -61.69 1.73 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.646 -0.706 . . . . 7.2 110.531 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 37.0 mttt 65.52 108.99 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.298 0 O-C-N 123.876 0.735 . . . . 7.58 111.471 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 79.4 14.16 81.8 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.811 -0.709 . . . . 5.57 112.297 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.484 ' HB2' ' HB3' ' B' ' 67' ' ' LEU . 1.3 mp0 -125.19 157.37 36.65 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.237 -0.653 . . . . 5.43 109.237 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 71' ' ' VAL . . . . . 0.554 HG11 ' HA ' ' A' ' 8' ' ' GLN . 13.4 p -107.75 136.51 42.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.377 0.608 . . . . 5.65 111.121 -179.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 11.5 tp -123.25 111.44 16.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.696 -0.684 . . . . 4.51 109.938 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . 0.412 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 0.3 OUTLIER -89.13 117.02 27.82 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.125 -0.489 . . . . 6.35 111.038 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 7.6 p -116.18 135.87 54.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.753 -0.462 . . . . 4.34 109.753 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 22.8 ttt -106.91 110.57 22.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.21 0.528 . . . . 5.42 111.142 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.411 ' HE2' ' HD1' ' B' ' 78' ' ' PHE . 45.1 p90 -137.07 -178.98 5.44 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.661 -0.7 . . . . 3.54 109.245 179.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 77' ' ' ARG . . . . . 0.583 ' HD2' ' HB3' ' B' ' 85' ' ' TRP . 37.9 mtm180 -106.5 122.2 45.81 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.08 0.467 . . . . 6.8 110.626 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.624 ' HD2' HG11 ' B' ' 33' ' ' VAL . 15.6 t80 -103.81 150.58 23.98 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.64 -0.709 . . . . 5.79 109.889 -179.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 79' ' ' ARG . . . . . 0.429 HH11 ' HD3' ' B' ' 79' ' ' ARG . 30.1 ttp180 -89.62 134.22 34.24 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.383 -0.371 . . . . 11.08 110.468 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 82.0 p -93.29 -176.38 4.12 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.217 -0.447 . . . . 7.47 110.087 179.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -70.73 -14.93 62.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.428 0.632 . . . . 12.24 109.391 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 68.5 m-20 -92.11 1.08 57.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.373 -0.83 . . . . 9.25 109.489 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 83' ' ' GLN . . . . . 0.425 ' HA ' ' HG2' ' B' ' 79' ' ' ARG . 2.3 mp0 67.03 22.79 9.9 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.167 -0.924 . . . . 8.3 111.241 -179.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -94.31 157.2 16.15 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.465 -0.569 . . . . 6.78 109.465 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . 0.583 ' HB3' ' HD2' ' B' ' 77' ' ' ARG . 81.6 m95 -99.38 116.45 31.57 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.832 0.348 . . . . 7.89 110.835 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 pp -119.32 145.83 45.81 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.174 -0.467 . . . . 6.97 110.027 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 87' ' ' TRP . . . . . 0.42 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 94.7 m95 -76.39 120.62 21.89 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.098 0.475 . . . . 8.55 110.777 -179.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 30.7 tpp -119.62 128.99 54.37 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.49 -0.777 . . . . 4.46 111.166 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 20.4 ttp180 -99.2 82.54 2.72 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.714 -0.847 . . . . 6.87 108.714 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 90' ' ' THR . . . . . 0.493 HG23 ' HB3' ' B' ' 108' ' ' CYS . 47.8 m -75.66 114.87 14.74 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.534 -0.757 . . . . 6.18 111.712 -178.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 91' ' ' SER . . . . . 0.412 ' HA ' ' HA ' ' B' ' 73' ' ' SER . 1.4 m -96.73 95.93 8.25 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.565 -0.743 . . . . 6.3 109.119 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 10.3 m -84.07 123.4 30.0 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.185 -0.461 . . . . 6.65 112.028 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . 0.46 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 65.0 t80 -120.48 122.58 40.97 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.92 -0.582 . . . . 6.45 109.555 179.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.79 113.89 21.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.708 0.29 . . . . 9.17 111.368 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 95' ' ' PHE . . . . . 0.491 ' HD1' ' HA ' ' B' ' 95' ' ' PHE . 0.0 OUTLIER -82.68 122.6 28.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 8.33 110.188 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -98.45 119.35 36.99 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.705 -0.679 . . . . 10.53 111.041 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 97' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -71.27 123.76 89.89 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 108.78 -0.822 . . . . 8.43 108.78 178.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.68 21.67 0.17 Allowed 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.023 2.482 . . . . 9.16 114.151 -178.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -94.69 -68.72 0.79 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.564 -0.532 . . . . 11.34 109.564 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 6.1 m -129.66 20.1 5.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.088 -0.505 . . . . 7.75 110.252 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 33.7 t70 66.72 41.54 2.93 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.349 -0.842 . . . . 9.08 111.19 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -96.2 140.06 31.45 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.403 -0.362 . . . . 7.71 110.258 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 63.5 mt -79.63 108.83 13.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.561 -0.533 . . . . 8.04 109.561 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.472 ' H ' ' HG2' ' B' ' 104' ' ' GLU . 6.4 pt-20 -72.94 -45.18 59.52 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.519 -0.309 . . . . 8.81 111.025 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -165.55 167.6 17.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.455 -0.339 . . . . 7.4 110.382 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 67.5 mt -106.0 121.85 58.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.959 -0.564 . . . . 6.78 110.155 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.568 HG23 HG13 ' B' ' 13' ' ' ILE . 83.4 mt -87.75 100.03 9.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.893 -0.594 . . . . 6.31 109.734 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 108' ' ' CYS . . . . . 0.493 ' HB3' HG23 ' B' ' 90' ' ' THR . 68.1 m -100.6 97.91 8.54 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 120.823 -0.351 . . . . 5.31 111.522 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 46.3 m -75.36 99.29 4.08 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.121 -0.696 . . . . 5.48 109.121 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 110' ' ' ASN . . . . . 0.553 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.3 m-20 -80.46 109.27 14.81 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.654 -0.703 . . . . 6.9 110.899 -178.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 111' ' ' THR . . . . . 0.472 HG23 ' HB2' ' B' ' 11' ' ' GLU . 0.3 OUTLIER -113.09 110.88 21.19 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.114 -0.494 . . . . 8.61 110.127 179.245 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 112' ' ' ASN . . . . . 0.722 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 10.8 t-20 -70.59 129.77 40.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.992 0.425 . . . . 11.84 110.754 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 38.8 t -106.36 -51.16 7.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.838 -0.619 . . . . 11.77 110.057 179.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . 0.42 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 34.4 mtpt . . . . . 0 C--O 1.246 0.889 0 CA-C-O 118.567 -0.73 . . . . 12.68 110.217 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.2 mm-40 . . . . . 0 C--O 1.234 0.288 0 N-CA-C 109.831 -0.433 . . . . 15.08 109.831 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.89 153.85 67.86 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.742 2.295 . . . . 13.43 112.751 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.812 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.2 OUTLIER -79.53 52.49 1.4 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.347 0.594 . . . . 11.09 111.079 179.609 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.496 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 40.8 tt0 -152.37 123.75 7.72 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.417 -0.81 . . . . 10.59 108.825 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.784 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 44.7 p90 -139.79 151.11 45.5 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.066 0.46 . . . . 8.93 111.732 -178.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.596 HG13 HD13 ' B' ' 107' ' ' ILE . 0.0 OUTLIER -111.32 129.31 66.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.784 -0.644 . . . . 8.66 109.866 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.5 m -134.32 139.29 45.57 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.316 0.579 . . . . 6.11 112.35 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.6 ' HD2' ' HD2' ' A' ' 24' ' ' PHE . 6.5 mtt85 -89.54 133.37 34.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.161 -0.927 . . . . 9.09 108.978 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.516 ' CB ' ' HA ' ' A' ' 22' ' ' PHE . 33.5 p80 -154.89 158.69 39.71 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.183 0.516 . . . . 9.79 111.751 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -65.85 155.7 35.53 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.992 -1.004 . . . . 12.69 109.278 178.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 18.4 pt -53.87 -31.02 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 N-CA-C 112.406 0.521 . . . . 13.58 112.406 -179.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -75.12 -16.59 60.53 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.821 0.343 . . . . 13.85 111.83 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 120.58 -19.48 9.08 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.308 -0.949 . . . . 9.38 113.553 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.487 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 30.6 mm -57.5 110.36 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 116.829 0.314 . . . . 10.74 110.978 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.516 ' HA ' ' CB ' ' A' ' 16' ' ' HIS . 82.3 m-85 -71.95 138.78 48.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.973 0.416 . . . . 9.73 111.457 -179.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.6 m -115.4 -36.9 4.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.756 -0.656 . . . . 7.74 110.891 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.6 ' HD2' ' HD2' ' A' ' 15' ' ' ARG . 18.6 t80 -139.48 110.7 6.95 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.409 -0.589 . . . . 6.92 109.409 179.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.546 HG21 ' HB2' ' A' ' 40' ' ' LEU . 7.3 t -97.61 150.24 4.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 116.447 -0.342 . . . . 6.02 110.776 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.784 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 7.8 t70 -69.35 172.58 6.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.704 -0.68 . . . . 7.31 110.087 179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -91.02 -21.38 21.3 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.124 0.488 . . . . 11.67 109.828 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 76.5 mtm180 -84.41 5.69 26.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.633 -0.712 . . . . 11.91 111.943 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 4.5 p -59.94 -42.92 95.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.323 0.582 . . . . 12.99 110.441 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.672 HG13 HE22 ' A' ' 36' ' ' GLN . 4.1 t -66.45 -28.88 44.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.522 -0.763 . . . . 16.15 111.04 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.24 -6.12 59.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.16 -0.473 . . . . 15.07 111.684 -179.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.487 ' HA ' HG22 ' A' ' 10' ' ' THR . 18.4 m -109.71 -56.99 2.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.724 0.297 . . . . 14.9 111.334 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.593 HG23 ' H ' ' A' ' 35' ' ' TYR . 11.1 m -113.17 -19.61 6.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.704 0.288 . . . . 13.84 111.702 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 94.51 -8.84 71.73 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.462 -0.875 . . . . 13.85 112.359 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.593 ' H ' HG23 ' A' ' 33' ' ' VAL . 4.6 m-85 -74.01 136.76 43.17 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.377 -0.231 . . . . 18.28 110.377 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.672 HE22 HG13 ' A' ' 30' ' ' VAL . 33.3 mm-40 -80.7 153.54 73.16 Favored Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 109.139 -0.689 . . . . 15.48 109.139 178.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.572 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 52.6 Cg_exo -53.56 -38.97 84.18 Favored 'Trans proline' 0 CA--C 1.529 0.237 0 C-N-CA 122.568 2.179 . . . . 11.63 112.712 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -71.11 -14.63 62.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.219 -0.446 . . . . 13.31 111.665 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.529 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 34.2 mt-10 -82.31 -20.65 36.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.911 0.386 . . . . 17.34 110.366 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.546 ' HB2' HG21 ' A' ' 25' ' ' VAL . 3.3 mm? -95.51 -24.11 16.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.771 -0.649 . . . . 13.25 110.495 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 82.5 mt -61.0 122.79 15.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.849 -0.614 . . . . 12.99 111.028 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . 0.405 ' HA2' HG23 ' A' ' 21' ' ' ILE . . . 76.31 9.18 85.82 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.879 -0.677 . . . . 13.39 112.586 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.738 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 9.0 mmpt? -114.1 153.39 29.57 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.908 0.385 . . . . 16.87 110.667 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.512 ' HB3' HG12 ' A' ' 46' ' ' VAL . 16.2 m120 -94.84 138.22 32.9 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.85 -0.613 . . . . 12.5 109.48 179.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.7 tt -61.14 -23.23 29.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.146 0.498 . . . . 11.72 110.856 179.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.512 HG12 ' HB3' ' A' ' 44' ' ' ASN . 11.5 p -70.8 -20.71 22.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 116.075 -0.511 . . . . 12.89 111.432 -179.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.405 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 45.3 mt-10 -72.75 -39.24 66.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.194 0.521 . . . . 16.53 110.461 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -97.36 19.44 13.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.679 -0.691 . . . . 15.34 110.396 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.506 ' SG ' HD12 ' A' ' 57' ' ' LEU . 49.8 t -104.56 149.5 25.45 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.837 -0.619 . . . . 11.97 110.513 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.406 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 4.9 t-160 -58.16 125.31 74.26 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.507 -0.77 . . . . 14.67 109.335 178.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.454 ' HA ' ' CD ' ' A' ' 54' ' ' GLN . 88.5 Cg_exo -48.89 -38.99 39.52 Favored 'Trans proline' 0 CA--C 1.533 0.452 0 C-N-CA 123.089 2.526 . . . . 15.15 113.823 -178.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -81.46 0.67 36.69 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.939 0.348 . . . . 16.47 111.939 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.406 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 36.7 m-20 -125.76 2.31 7.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.831 0.348 . . . . 13.16 110.978 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.454 ' CD ' ' HA ' ' A' ' 51' ' ' PRO . 85.5 mt-30 -61.99 -39.76 93.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.134 -0.484 . . . . 15.83 111.059 -179.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 -66.74 -44.38 81.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.262 -0.426 . . . . 13.94 110.211 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.2 tp -59.96 -41.97 93.08 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.218 -0.446 . . . . 12.11 110.37 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.506 HD12 ' SG ' ' A' ' 49' ' ' CYS . 0.2 OUTLIER -62.56 -53.09 59.91 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.003 -0.544 . . . . 9.71 110.114 179.307 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.427 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 52.7 ttt180 -59.77 -45.52 92.01 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.581 -0.736 . . . . 11.06 111.412 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -58.58 -46.72 86.32 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.335 -0.393 . . . . 9.71 111.025 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.3 m -66.46 -33.65 76.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.201 -0.454 . . . . 9.52 110.812 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.466 ' O ' HG12 ' A' ' 64' ' ' VAL . 1.8 m-30 -64.44 -30.08 71.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.065 0.459 . . . . 11.4 109.924 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 58' ' ' ARG . 18.7 mm100 -79.13 -31.72 44.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.855 -0.611 . . . . 10.04 110.236 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -66.49 -42.49 87.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.876 -0.602 . . . . 10.6 110.972 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.466 HG12 ' O ' ' A' ' 61' ' ' PHE . 9.5 p -64.01 -25.98 39.43 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-O 121.011 0.434 . . . . 10.62 110.399 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.499 ' HA ' HG21 ' A' ' 94' ' ' THR . 82.7 t -72.58 -38.31 58.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 109.382 -0.599 . . . . 12.41 109.382 178.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 41.5 mtpt -68.98 -40.81 78.57 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.717 -0.674 . . . . 16.25 110.022 179.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.703 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 86.9 mt -62.57 -49.63 74.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.669 -0.696 . . . . 12.66 110.75 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 62.5 mttt 66.01 99.37 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.815 -0.63 . . . . 14.83 112.394 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 82.16 14.37 77.04 Favored Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 121.029 -0.605 . . . . 9.8 113.356 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.703 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 7.3 tp-100 -119.74 123.62 44.19 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.551 -0.537 . . . . 9.59 109.551 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 6.8 p -71.35 126.32 31.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.297 0.57 . . . . 8.1 111.128 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 22.4 tp -115.73 123.97 49.64 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.811 -0.631 . . . . 7.8 109.706 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -92.54 116.7 29.23 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.085 -0.507 . . . . 7.59 111.262 -179.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.1 p -119.56 122.8 69.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.106 0.479 . . . . 7.84 110.253 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 11.7 ttt -100.36 127.31 46.71 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.259 -0.428 . . . . 9.35 111.172 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.502 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 45.3 p90 -154.18 -179.57 8.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.915 -0.584 . . . . 9.66 109.755 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.474 ' HD2' ' HB3' ' A' ' 85' ' ' TRP . 11.4 mtm180 -100.86 119.83 39.25 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.907 0.384 . . . . 13.1 109.987 179.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.502 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 21.5 t80 -104.9 150.59 24.74 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.883 -0.598 . . . . 9.28 110.475 -179.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.54 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 28.3 ttp180 -86.5 133.08 33.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.323 -0.399 . . . . 10.87 110.573 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 59.8 p -93.11 -175.36 3.83 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.675 -0.491 . . . . 10.77 109.675 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.464 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 37.6 tptt -72.24 -14.65 61.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.25 0.548 . . . . 12.66 109.704 178.514 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -95.48 5.23 52.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.729 -0.668 . . . . 14.42 109.768 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 68.08 23.58 8.02 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.162 -0.926 . . . . 12.69 112.018 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.5 pt-20 -94.01 161.88 14.11 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.789 -0.449 . . . . 10.85 109.789 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.54 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 81.7 m95 -107.16 106.16 16.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.816 0.341 . . . . 11.2 110.288 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.486 HD21 HG12 ' A' ' 33' ' ' VAL . 1.6 pp -105.78 148.67 27.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.198 -0.455 . . . . 11.12 110.866 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.673 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 96.3 m95 -81.29 117.18 21.57 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.294 -0.412 . . . . 10.28 110.068 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.484 ' SD ' ' HB3' ' A' ' 110' ' ' ASN . 3.7 ttp -130.61 141.52 50.44 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.255 -0.43 . . . . 9.32 111.193 -179.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -103.25 100.49 10.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.717 -0.674 . . . . 10.66 109.323 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.525 HG23 ' HB3' ' A' ' 108' ' ' CYS . 37.7 m -82.91 113.93 20.85 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.247 0.546 . . . . 9.37 111.511 -179.289 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.673 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 0.7 OUTLIER -91.78 91.15 7.81 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.688 -0.856 . . . . 8.27 108.688 178.382 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.1 m -82.0 131.07 35.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.075 -0.511 . . . . 8.65 111.896 -178.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -127.12 121.6 31.88 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.771 -0.65 . . . . 11.56 109.812 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.499 HG21 ' HA ' ' A' ' 65' ' ' VAL . 0.0 OUTLIER -76.31 111.28 11.58 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.911 0.386 . . . . 10.16 110.695 179.717 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -81.44 100.73 9.44 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.136 0.493 . . . . 12.25 110.049 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.518 ' HG2' HG12 ' A' ' 103' ' ' ILE . 37.4 mt-30 -90.2 152.99 20.84 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.732 -0.667 . . . . 14.24 111.31 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.446 ' OD1' ' HB2' ' A' ' 99' ' ' TYR . 15.6 t-20 -102.82 130.35 23.99 Favored Pre-proline 0 C--N 1.32 -0.684 0 CA-C-N 115.427 -0.806 . . . . 13.83 109.046 179.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -76.22 54.62 4.29 Favored 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.576 2.184 . . . . 15.34 112.876 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.446 ' HB2' ' OD1' ' A' ' 97' ' ' ASN . 4.3 t80 -125.95 -55.25 1.49 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 16.89 110.348 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -138.41 22.2 2.75 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.983 -0.553 . . . . 14.89 109.746 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 10.0 t70 63.29 33.23 14.24 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.59 -0.732 . . . . 14.77 110.021 -179.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -90.45 162.58 15.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.92 -0.582 . . . . 12.95 110.289 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.518 HG12 ' HG2' ' A' ' 96' ' ' GLN . 43.8 mt -110.58 119.85 60.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.78 -0.452 . . . . 11.11 109.78 179.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.81 -40.76 27.85 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.856 -0.338 . . . . 11.65 110.737 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 14.4 p90 -169.16 -178.18 3.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.258 -0.428 . . . . 10.3 110.209 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 73.0 mt -121.59 127.16 75.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.876 0.37 . . . . 10.29 110.88 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.564 HG22 HG22 ' A' ' 13' ' ' ILE . 19.3 mt -99.62 122.3 51.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 108.623 -0.88 . . . . 8.99 108.623 178.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.525 ' HB3' HG23 ' A' ' 90' ' ' THR . 81.5 m -110.26 132.21 54.37 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.255 0.55 . . . . 9.83 112.452 -178.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.707 HG21 HG13 ' B' ' 13' ' ' ILE . 12.8 m -100.27 95.8 7.03 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.776 -1.102 . . . . 10.84 108.447 178.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.496 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 6.7 m-20 -81.93 105.85 13.38 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.093 -0.503 . . . . 11.26 111.839 -178.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 1.7 m -102.3 112.56 25.31 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.802 -0.635 . . . . 11.22 110.085 178.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . 0.812 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 10.0 t-20 -72.47 125.28 27.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.905 0.383 . . . . 12.78 110.55 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 46.4 t -102.98 -50.21 9.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.158 -0.474 . . . . 14.64 109.897 179.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.673 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 89.8 mttt . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.283 -0.865 . . . . 16.02 110.09 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 80.3 m . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 109.939 -0.393 . . . . 7.49 109.939 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' GLN . . . . . 0.411 ' HA ' ' HD3' ' B' ' 9' ' ' PRO . 18.5 mm-40 -133.74 146.32 59.76 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 116.646 -0.252 . . . . 7.12 110.537 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' PRO . . . . . 0.706 ' HD2' ' HG2' ' B' ' 28' ' ' ARG . 18.1 Cg_exo -67.54 167.57 20.46 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 123.025 2.483 . . . . 6.18 112.104 179.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.97 57.89 3.62 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.479 0.656 . . . . 5.81 111.136 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.508 ' HA ' ' O ' ' B' ' 110' ' ' ASN . 0.0 OUTLIER -166.62 148.62 6.46 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.315 -0.995 . . . . 5.85 108.315 179.043 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 47.7 p90 -156.21 162.74 40.14 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.422 0.629 . . . . 6.08 112.06 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.707 HG13 HG21 ' A' ' 109' ' ' THR . 27.0 mm -96.33 117.35 40.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 114.912 -1.04 . . . . 5.57 110.409 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.468 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.9 OUTLIER -106.86 101.86 11.26 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.005 -0.543 . . . . 5.3 110.831 -179.769 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . 0.562 ' HD3' ' HB3' ' B' ' 24' ' ' PHE . 26.8 mtp85 -91.94 108.01 19.62 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.175 -0.676 . . . . 8.97 109.175 179.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . 0.553 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 31.9 p80 -139.55 164.46 29.84 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.345 -0.389 . . . . 8.31 110.897 -178.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 10.8 p-10 -75.71 -177.83 3.92 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.408 -0.36 . . . . 10.83 110.48 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 33.9 pt -65.64 -28.17 43.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 112.455 0.539 . . . . 8.89 112.455 -178.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -72.69 -32.75 66.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.724 0.297 . . . . 11.92 110.934 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 125.58 -11.4 7.52 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.578 -0.82 . . . . 8.57 112.267 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . 0.406 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 39.3 mm -62.12 112.64 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.775 0.321 . . . . 10.87 110.388 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . 0.553 ' HA ' ' HB3' ' B' ' 16' ' ' HIS . 97.2 m-85 -69.81 129.68 40.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.97 -0.559 . . . . 8.23 111.279 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.85 -33.91 7.82 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.82 -0.627 . . . . 7.91 110.607 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . 0.562 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 37.8 t80 -152.05 124.69 8.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.33 -0.396 . . . . 7.89 110.483 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 4.8 t -125.88 141.11 46.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.077 -0.511 . . . . 6.1 109.973 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -73.68 159.81 32.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.899 0.381 . . . . 7.15 110.222 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 35.8 m80 -69.28 -10.34 57.39 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.088 -0.506 . . . . 8.97 112.036 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . 0.706 ' HG2' ' HD2' ' B' ' 9' ' ' PRO . 60.9 mtm180 -67.1 -20.06 65.73 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.429 0.529 . . . . 9.76 112.429 -179.202 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 32.1 p -59.75 -29.86 68.45 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.144 0.424 . . . . 11.56 112.144 -178.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.733 HG13 HE22 ' B' ' 36' ' ' GLN . 21.8 t -61.94 -37.57 78.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.216 -0.447 . . . . 13.64 112.059 -178.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -91.85 -12.65 33.05 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.019 0.438 . . . . 12.9 111.181 -179.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 16.3 m -88.14 -64.71 1.1 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.252 -0.431 . . . . 12.13 111.368 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' VAL . . . . . 0.538 HG23 ' H ' ' B' ' 35' ' ' TYR . 6.9 m -108.64 -13.0 10.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.755 0.312 . . . . 13.87 111.614 -179.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' GLY . . . . . 0.435 ' HA2' ' O ' ' B' ' 30' ' ' VAL . . . 89.65 -12.68 66.32 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.573 -0.822 . . . . 13.79 112.003 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' TYR . . . . . 0.538 ' H ' HG23 ' B' ' 33' ' ' VAL . 14.9 m-85 -73.12 141.2 47.49 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.682 0.277 . . . . 15.38 110.632 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . 0.733 HE22 HG13 ' B' ' 30' ' ' VAL . 34.7 mm-40 -84.64 148.65 52.31 Favored Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 108.902 -0.777 . . . . 13.78 108.902 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.715 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 52.4 Cg_exo -52.63 -39.78 74.91 Favored 'Trans proline' 0 N--CA 1.465 -0.153 0 C-N-CA 122.301 2.001 . . . . 14.71 111.986 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 26.0 mp0 -65.9 -20.24 66.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.938 -0.573 . . . . 17.54 112.22 -179.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.557 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 42.6 mt-10 -79.15 -39.35 33.74 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.892 -0.41 . . . . 14.24 109.892 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -73.41 -34.21 65.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.905 -0.589 . . . . 14.03 111.207 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.715 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 56.6 mt -59.18 114.66 2.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.96 0.409 . . . . 13.62 111.304 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 98.32 -7.72 62.11 Favored Glycine 0 N--CA 1.45 -0.422 0 CA-C-N 115.825 -0.625 . . . . 11.62 112.44 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.442 ' HE2' ' HA ' ' B' ' 43' ' ' LYS . 1.4 mmpt? -108.47 166.68 10.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.74 0.305 . . . . 13.82 110.925 -179.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' ASN . . . . . 0.805 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 12.8 m120 -103.04 149.33 24.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.801 -0.636 . . . . 10.16 109.959 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 18.9 tt -71.48 -27.34 28.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.957 0.408 . . . . 9.62 110.819 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 9.9 p -71.76 -20.53 20.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-O 120.986 0.422 . . . . 11.5 111.413 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . 0.805 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 41.8 mt-10 -70.52 -34.47 72.34 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.254 -0.43 . . . . 11.89 110.98 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -103.08 26.3 8.39 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.109 -0.496 . . . . 13.6 110.147 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 49.8 t -107.57 152.55 24.11 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.001 -0.545 . . . . 10.81 111.082 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' HIS . . . . . 0.456 ' HB2' ' HB2' ' B' ' 77' ' ' ARG . 8.8 t-80 -63.92 130.29 94.38 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 115.401 -0.818 . . . . 11.49 109.538 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' PRO . . . . . 0.436 ' HD2' ' CD2' ' B' ' 50' ' ' HIS . 85.9 Cg_exo -43.53 -51.18 6.28 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.606 2.871 . . . . 11.35 114.438 -179.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -72.98 -3.91 28.96 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.375 0.509 . . . . 9.28 112.375 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . 0.603 ' HB3' ' HB2' ' B' ' 76' ' ' PHE . 14.8 m-20 -118.35 3.86 11.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.986 0.422 . . . . 7.52 110.692 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -68.2 -48.23 65.79 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.919 -0.582 . . . . 6.57 111.524 -178.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 49.7 tp60 -65.23 -33.49 76.12 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.858 -0.423 . . . . 6.58 109.858 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 22.0 tp -61.38 -39.23 89.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.963 -0.562 . . . . 4.6 109.993 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 1.1 mt -66.39 -47.47 73.23 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.786 -0.643 . . . . 6.4 110.272 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -61.95 -46.09 90.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.807 -0.633 . . . . 8.18 111.036 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -58.95 -45.68 89.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.47 . . . . 6.07 111.056 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 15.7 m -66.84 -36.4 82.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.247 -0.433 . . . . 5.59 110.869 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 61' ' ' PHE . . . . . 0.633 ' O ' HG12 ' B' ' 64' ' ' VAL . 1.7 m-30 -64.64 -42.8 95.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.732 0.301 . . . . 7.73 110.539 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -65.17 -28.75 69.62 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.079 0.466 . . . . 6.89 110.405 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -76.82 -37.86 54.94 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.993 -0.549 . . . . 9.4 111.021 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.727 ' HA ' HD12 ' B' ' 67' ' ' LEU . 2.8 p -65.74 -27.46 41.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 CA-C-O 120.775 0.321 . . . . 7.57 110.474 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . 0.444 HG23 ' O ' ' B' ' 61' ' ' PHE . 92.4 t -69.77 -34.77 62.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.327 0.585 . . . . 7.43 109.605 178.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -80.27 -18.26 49.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.636 -0.711 . . . . 10.21 110.439 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.85 ' HB3' ' HB2' ' B' ' 70' ' ' GLN . 64.8 mt -74.3 -46.92 38.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.862 -0.608 . . . . 7.2 110.572 179.326 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 86.2 mttt 56.6 88.46 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.85 0.719 . . . . 7.58 112.538 179.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.55 -4.0 63.73 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.431 -0.89 . . . . 5.57 112.533 178.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.85 ' HB2' ' HB3' ' B' ' 67' ' ' LEU . 2.3 mp0 -104.68 141.53 36.28 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 110.164 -0.31 . . . . 5.43 110.164 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 71' ' ' VAL . . . . . 0.832 ' HB ' ' HD1' ' B' ' 93' ' ' PHE . 7.1 p -92.94 132.33 37.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.151 0.5 . . . . 5.65 111.054 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 14.9 tp -119.98 111.73 18.28 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.917 -0.583 . . . . 4.51 109.435 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . 0.611 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.2 p -91.24 110.29 21.57 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.208 -0.451 . . . . 6.35 110.926 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.1 p -103.83 128.69 56.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.122 -0.49 . . . . 4.34 110.107 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 28.4 ttt -99.29 109.11 21.78 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.366 -0.379 . . . . 5.42 110.292 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.603 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 51.5 p90 -138.6 -173.64 3.61 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.058 -0.519 . . . . 3.54 110.121 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 77' ' ' ARG . . . . . 0.456 ' HB2' ' HB2' ' B' ' 50' ' ' HIS . 26.3 mtt180 -106.64 115.61 30.49 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.754 0.311 . . . . 6.8 110.32 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -102.64 149.45 24.43 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.035 -0.53 . . . . 5.79 110.021 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 79' ' ' ARG . . . . . 0.584 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 17.5 ttp180 -88.88 133.06 34.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.925 0.393 . . . . 11.08 110.618 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . 0.492 ' OG ' ' HG2' ' B' ' 84' ' ' GLU . 91.0 p -94.58 -176.33 3.88 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.683 -0.488 . . . . 7.47 109.683 178.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . 0.444 ' HA ' ' HD2' ' B' ' 81' ' ' LYS . 40.2 tptt -68.26 -16.22 63.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.27 0.557 . . . . 12.24 110.014 179.077 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -88.11 -0.54 57.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.678 -0.692 . . . . 9.25 109.884 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 65.93 28.78 10.54 Favored 'General case' 0 C--N 1.334 -0.076 0 CA-C-N 115.551 -0.75 . . . . 8.3 110.795 -179.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . 0.492 ' HG2' ' OG ' ' B' ' 80' ' ' SER . 12.2 pt-20 -106.53 163.72 12.65 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.031 -0.729 . . . . 6.78 109.031 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . 0.584 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 49.9 m95 -105.15 127.76 53.06 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.135 0.493 . . . . 7.89 111.426 -179.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -129.26 151.3 50.06 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.792 -0.64 . . . . 6.97 109.814 179.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 87' ' ' TRP . . . . . 0.541 ' HD1' ' HB2' ' B' ' 114' ' ' LYS . 98.8 m95 -75.65 111.57 11.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.358 0.599 . . . . 8.55 110.511 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 88' ' ' MET . . . . . 0.414 ' SD ' ' HB3' ' B' ' 110' ' ' ASN . 47.0 tpp -116.0 123.44 48.01 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.248 -0.887 . . . . 4.46 110.722 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 33.3 ttp180 -97.76 83.27 3.16 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.592 -0.892 . . . . 6.87 108.592 178.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 90' ' ' THR . . . . . 0.636 HG23 ' HB3' ' B' ' 108' ' ' CYS . 36.2 m -72.06 109.45 5.87 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.418 -0.81 . . . . 6.18 111.231 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 91' ' ' SER . . . . . 0.67 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 1.9 m -90.38 87.89 6.97 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.697 -0.683 . . . . 6.3 109.339 179.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 92' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' B' ' 108' ' ' CYS . 9.2 m -75.39 120.46 20.87 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.84 -0.618 . . . . 6.65 111.517 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . 0.832 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 55.8 t80 -116.88 124.22 48.94 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.943 -0.572 . . . . 6.45 110.085 179.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . 0.522 HG22 HG21 ' B' ' 103' ' ' ILE . 0.3 OUTLIER -83.69 103.26 12.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.881 0.372 . . . . 9.17 110.691 179.76 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 95' ' ' PHE . . . . . 0.483 ' CZ ' ' HB ' ' A' ' 13' ' ' ILE . 0.0 OUTLIER -74.62 117.17 16.15 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.156 -0.474 . . . . 8.33 110.52 -179.647 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -83.25 116.91 22.62 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.751 -0.659 . . . . 10.53 110.584 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 97' ' ' ASN . . . . . 0.484 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 62.7 t30 -80.74 127.84 73.83 Favored Pre-proline 0 C--N 1.322 -0.625 0 N-CA-C 109.251 -0.648 . . . . 8.43 109.251 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 98' ' ' PRO . . . . . 0.484 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 23.5 Cg_endo -62.32 73.27 0.11 Allowed 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.257 2.638 . . . . 9.16 113.054 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . 0.424 ' HB3' ' H ' ' B' ' 100' ' ' SER . 3.6 m-85 -147.4 -137.58 0.09 Allowed 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.818 -0.808 . . . . 11.34 108.818 179.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 100' ' ' SER . . . . . 0.424 ' H ' ' HB3' ' B' ' 99' ' ' TYR . 0.3 OUTLIER -80.54 49.3 1.15 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.665 0.269 . . . . 7.75 110.968 179.437 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 38.8 t70 50.53 77.0 0.13 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.719 -0.673 . . . . 9.08 111.101 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . 0.463 ' HG3' ' HB3' ' B' ' 97' ' ' ASN . 3.4 pt-20 -133.43 151.46 51.8 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.946 0.403 . . . . 7.71 111.459 -179.143 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 103' ' ' ILE . . . . . 0.522 HG21 HG22 ' B' ' 94' ' ' THR . 40.2 mt -94.9 98.3 7.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.638 -0.71 . . . . 8.04 109.146 178.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -58.45 -47.8 82.8 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.985 -0.552 . . . . 8.81 110.723 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 105' ' ' TYR . . . . . 0.445 ' HE1' HD11 ' B' ' 107' ' ' ILE . 8.1 p90 -161.31 163.49 30.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.104 -0.498 . . . . 7.4 110.133 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 62.6 mt -105.16 114.32 44.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.896 -0.593 . . . . 6.78 109.686 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.688 HG23 HG23 ' B' ' 13' ' ' ILE . 88.1 mt -86.87 104.21 13.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.008 -0.542 . . . . 6.31 109.697 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 108' ' ' CYS . . . . . 0.636 ' HB3' HG23 ' B' ' 90' ' ' THR . 75.6 m -94.43 108.49 20.41 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.967 -0.561 . . . . 5.31 111.632 -179.179 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . 0.67 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 27.5 m -82.47 90.94 6.79 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.94 -0.763 . . . . 5.48 108.94 177.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 110' ' ' ASN . . . . . 0.508 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.0 m-20 -72.24 106.86 4.59 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.836 -0.62 . . . . 6.9 111.363 -178.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 1.4 m -108.72 109.03 20.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.308 -0.406 . . . . 8.61 110.189 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -70.95 127.07 31.35 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.987 0.422 . . . . 11.84 110.586 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 113' ' ' VAL . . . . . 0.4 HG12 ' HG3' ' B' ' 114' ' ' LYS . 35.2 t -100.23 -55.46 5.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.769 -0.65 . . . . 11.77 109.751 179.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . 0.541 ' HB2' ' HD1' ' B' ' 87' ' ' TRP . 45.4 mtpt . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.516 -0.754 . . . . 12.68 109.703 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.7 mm-40 . . . . . 0 N--CA 1.454 -0.265 0 N-CA-C 109.689 -0.485 . . . . 15.08 109.689 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.65 164.85 34.41 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.769 2.312 . . . . 13.43 112.556 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.716 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.2 OUTLIER -82.89 52.0 2.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.154 0.502 . . . . 11.09 110.975 179.737 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.44 ' HB2' HG23 ' A' ' 111' ' ' THR . 40.2 tt0 -156.41 129.97 8.26 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.782 -0.645 . . . . 10.59 109.479 -179.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.945 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 39.4 p90 -144.83 145.11 31.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.937 0.399 . . . . 8.93 111.425 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.51 HG23 HG23 ' A' ' 107' ' ' ILE . 2.5 mp -93.57 117.93 38.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 109.795 -0.446 . . . . 8.66 109.795 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 52.8 p -105.16 121.97 44.94 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.233 0.539 . . . . 6.11 111.057 -179.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.9 mtp180 -97.85 102.9 14.77 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.303 -0.999 . . . . 9.09 108.303 178.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.407 ' O ' ' HB2' ' A' ' 105' ' ' TYR . 31.8 p80 -130.46 153.85 48.36 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.511 -0.313 . . . . 9.79 110.931 -178.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -69.18 173.98 5.1 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.475 -0.329 . . . . 12.69 110.236 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.0 pt -58.83 -29.51 40.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 112.802 0.667 . . . . 13.58 112.802 -178.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -73.94 -21.38 60.06 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.887 0.375 . . . . 13.85 111.465 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 112.12 -0.93 26.92 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 120.436 -0.888 . . . . 9.38 112.509 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.423 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 40.2 mm -72.98 118.45 18.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.679 -0.489 . . . . 10.74 109.679 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.418 ' CG ' ' HB3' ' A' ' 40' ' ' LEU . 86.9 m-85 -69.41 113.63 6.89 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.183 -0.462 . . . . 9.73 111.507 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.83 -35.95 23.85 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.355 0.598 . . . . 7.74 109.659 178.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -152.78 125.85 8.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.312 -0.858 . . . . 6.92 108.985 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.62 HG21 ' HB2' ' A' ' 40' ' ' LEU . 2.5 t -110.35 147.88 14.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.953 0.406 . . . . 6.02 111.414 -178.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.945 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 6.4 t70 -68.81 168.9 12.46 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.874 -0.603 . . . . 7.31 109.764 179.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 60.5 m170 -95.34 -11.96 26.9 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.995 0.426 . . . . 11.67 110.574 -179.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 85.6 mtm180 -82.0 -5.94 58.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.895 -0.593 . . . . 11.91 111.947 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.6 p -60.88 -27.37 68.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.867 0.365 . . . . 12.99 111.163 -179.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.437 HG13 HE22 ' A' ' 36' ' ' GLN . 15.0 t -65.14 -32.67 59.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.045 -0.525 . . . . 16.15 110.823 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.52 -27.19 21.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.182 -0.463 . . . . 15.07 110.787 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.559 ' HA ' HG22 ' A' ' 10' ' ' THR . 4.0 m -76.63 -55.37 5.57 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.114 -0.494 . . . . 14.9 111.376 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.568 HG11 ' HD2' ' A' ' 78' ' ' PHE . 2.7 m -120.13 -30.07 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 111.871 0.322 . . . . 13.84 111.871 -179.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.436 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 110.48 -23.57 19.91 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.307 -0.949 . . . . 13.85 112.015 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -65.58 135.86 55.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.743 0.306 . . . . 18.28 110.529 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.638 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 48.7 mm-40 -77.3 150.41 80.11 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 109.16 -0.682 . . . . 15.48 109.16 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.567 ' HB3' ' HB ' ' A' ' 25' ' ' VAL . 53.6 Cg_exo -52.36 -40.0 71.82 Favored 'Trans proline' 0 CA--C 1.528 0.202 0 C-N-CA 122.443 2.095 . . . . 11.63 112.05 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.579 ' HA ' HD12 ' A' ' 41' ' ' LEU . 25.7 mp0 -65.6 -20.34 66.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.621 -0.718 . . . . 13.31 111.612 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.638 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 29.3 mt-10 -78.74 -28.14 44.89 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.146 -0.316 . . . . 17.34 110.146 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.62 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.7 mm? -86.58 -26.9 24.23 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.879 -0.601 . . . . 13.25 110.791 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.579 HD12 ' HA ' ' A' ' 38' ' ' GLN . 96.7 mt -60.43 119.34 7.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.106 -0.497 . . . . 12.99 110.824 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.9 3.8 82.8 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 121.01 -0.614 . . . . 13.39 112.41 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.517 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 8.3 mmpt? -113.95 161.2 17.95 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.224 -0.287 . . . . 16.87 110.224 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.653 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 16.8 m120 -98.06 136.37 38.41 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.669 -0.493 . . . . 12.5 109.669 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.493 HD13 ' HZ ' ' A' ' 61' ' ' PHE . 13.8 tt -58.8 -27.55 35.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.106 0.479 . . . . 11.72 110.992 179.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.2 p -71.21 -18.68 20.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.051 -0.522 . . . . 12.89 111.56 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.653 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.0 mt-10 -71.14 -34.63 71.21 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.035 0.445 . . . . 16.53 110.901 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.414 ' HB2' ' CZ ' ' A' ' 78' ' ' PHE . 30.7 m-85 -100.45 24.14 9.31 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.903 -0.59 . . . . 15.34 110.471 -179.147 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 46.0 t -110.57 150.19 29.3 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.059 -0.519 . . . . 11.97 110.063 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.527 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 6.8 t-160 -58.33 125.17 74.51 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 109.133 -0.691 . . . . 14.67 109.133 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_exo -45.63 -46.36 15.04 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 123.189 2.592 . . . . 15.15 113.679 -179.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -75.82 0.03 19.48 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.121 0.415 . . . . 16.47 112.121 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.527 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 9.5 m-20 -122.03 -0.17 9.54 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.963 0.411 . . . . 13.16 110.246 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -63.9 -45.47 89.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.791 -0.64 . . . . 15.83 111.557 -179.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.7 tp60 -66.46 -37.0 84.18 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.433 -0.58 . . . . 13.94 109.433 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.8 tp -59.48 -42.1 91.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.727 -0.67 . . . . 12.11 109.445 178.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -67.73 -51.24 51.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.521 -0.763 . . . . 9.71 110.327 179.159 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -57.29 -47.22 82.03 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.767 -0.651 . . . . 11.06 111.606 -179.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.478 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 31.3 t70 -58.96 -45.89 89.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.32 -0.4 . . . . 9.71 110.983 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.4 m -65.87 -33.27 75.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.966 -0.561 . . . . 9.52 111.022 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.593 ' O ' HG12 ' A' ' 64' ' ' VAL . 1.9 m-85 -62.88 -39.47 94.54 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.051 0.453 . . . . 11.4 110.163 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -70.22 -32.0 69.68 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.043 -0.526 . . . . 10.04 110.092 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.645 ' HA ' ' HD3' ' A' ' 66' ' ' LYS . 65.7 mt-30 -66.08 -39.02 89.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.95 -0.568 . . . . 10.6 111.219 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.593 HG12 ' O ' ' A' ' 61' ' ' PHE . 2.3 p -68.14 -25.38 31.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.854 0.359 . . . . 10.62 110.687 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.427 ' O ' ' HG3' ' A' ' 68' ' ' LYS . 86.6 t -73.6 -34.82 42.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 N-CA-C 109.157 -0.683 . . . . 12.41 109.157 178.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.645 ' HD3' ' HA ' ' A' ' 63' ' ' GLN . 45.3 mtpt -72.23 -38.99 68.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.518 -0.765 . . . . 16.25 109.634 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 65.9 mt -66.01 -53.49 38.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.296 -0.865 . . . . 12.66 111.034 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' A' ' 65' ' ' VAL . 62.7 mttt 60.33 91.46 0.05 Allowed 'General case' 0 N--CA 1.466 0.326 0 O-C-N 123.658 0.599 . . . . 14.83 112.38 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 105.74 -13.6 46.15 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.726 -0.75 . . . . 9.8 112.804 179.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.521 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 6.3 tp-100 -96.67 126.25 41.7 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.269 -0.271 . . . . 9.59 110.269 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.448 ' HA ' ' O ' ' A' ' 92' ' ' SER . 2.4 p -80.75 112.93 19.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.333 0.587 . . . . 8.1 110.587 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.3 tp -104.29 117.33 33.94 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.616 -0.72 . . . . 7.8 110.398 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.76 106.93 18.39 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.863 -0.608 . . . . 7.59 111.193 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.472 HG13 ' HB ' ' A' ' 90' ' ' THR . 2.6 p -101.28 122.98 54.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.112 0.482 . . . . 7.84 109.867 179.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 23.6 ttt -99.78 118.42 36.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.243 -0.435 . . . . 9.35 110.954 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.588 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 45.4 p90 -145.9 -171.65 3.75 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.663 -0.699 . . . . 9.66 109.279 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.454 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 44.9 mtm180 -110.55 120.12 41.39 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.055 0.455 . . . . 13.1 110.398 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.588 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 12.7 t80 -102.25 151.88 21.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.316 -0.856 . . . . 9.28 110.15 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.492 ' HA ' ' O ' ' A' ' 84' ' ' GLU . 37.9 ttp180 -88.61 128.16 35.58 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.171 -0.468 . . . . 10.87 110.471 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.474 ' HA ' ' HB ' ' A' ' 33' ' ' VAL . 54.9 p -88.47 -176.25 5.25 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.299 -0.41 . . . . 10.77 110.025 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.4 tptt -72.33 -14.23 61.69 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.104 -0.702 . . . . 12.66 109.104 178.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -90.74 1.38 56.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.316 -0.856 . . . . 14.42 109.489 178.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 67.82 22.91 8.63 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.207 -0.906 . . . . 12.69 111.316 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.492 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.5 pt-20 -96.1 167.95 10.9 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.755 -0.461 . . . . 10.85 109.755 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.464 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 77.2 m95 -108.92 108.31 19.02 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.582 -0.281 . . . . 11.2 110.562 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.529 HD21 HG12 ' A' ' 33' ' ' VAL . 2.6 pp -110.0 151.09 27.58 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.488 -0.324 . . . . 11.12 110.365 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.538 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 96.9 m95 -77.59 119.66 21.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.039 0.447 . . . . 10.28 110.527 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.437 ' SD ' ' HB3' ' A' ' 110' ' ' ASN . 30.5 tpp -119.2 135.41 54.69 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.776 -0.647 . . . . 9.32 111.063 -178.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -104.72 81.69 1.8 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.65 -0.87 . . . . 10.66 108.65 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.598 HG23 ' HB3' ' A' ' 108' ' ' CYS . 28.7 m -71.38 109.51 5.41 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.689 -0.687 . . . . 9.37 111.963 -178.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.487 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 0.7 OUTLIER -87.51 93.42 9.41 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.431 -0.804 . . . . 8.27 108.982 178.697 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.448 ' O ' ' HA ' ' A' ' 71' ' ' VAL . 16.4 m -81.91 124.02 29.35 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.04 0.448 . . . . 8.65 111.452 -178.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -125.63 125.06 42.52 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.746 -0.661 . . . . 11.56 109.93 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.69 129.51 37.22 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.297 -0.411 . . . . 10.16 111.474 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -114.04 109.97 19.29 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.376 -0.375 . . . . 12.25 110.079 179.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.41 ' HG3' HG12 ' A' ' 103' ' ' ILE . 0.0 OUTLIER -112.55 152.91 28.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.997 0.427 . . . . 14.24 110.966 -179.694 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -92.37 145.87 31.43 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 109.15 -0.685 . . . . 13.83 109.15 178.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.15 28.61 0.36 Allowed 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 122.65 2.233 . . . . 15.34 113.288 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -98.7 -64.69 1.01 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.145 0.498 . . . . 16.89 110.001 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.449 ' HB2' ' HG3' ' A' ' 102' ' ' GLU . 49.5 m -133.24 17.98 4.06 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.686 -0.688 . . . . 14.89 109.648 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.9 t70 63.62 34.16 12.62 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.272 -0.877 . . . . 14.77 109.811 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.449 ' HG3' ' HB2' ' A' ' 100' ' ' SER . 0.1 OUTLIER -80.3 130.22 35.04 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.181 -0.918 . . . . 12.95 110.154 -179.796 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.41 HG12 ' HG3' ' A' ' 96' ' ' GLN . 36.7 mt -81.15 106.74 12.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.872 -0.418 . . . . 11.11 109.872 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -70.58 -43.81 68.65 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.728 0.299 . . . . 11.65 110.328 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.407 ' HB2' ' O ' ' A' ' 16' ' ' HIS . 31.6 p90 -165.5 172.4 12.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.211 -0.449 . . . . 10.3 110.295 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 52.1 mt -110.86 122.76 65.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.106 -0.497 . . . . 10.29 110.529 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.51 HG23 HG23 ' A' ' 13' ' ' ILE . 87.4 mt -84.56 110.72 19.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.311 -0.626 . . . . 8.99 109.311 179.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.598 ' HB3' HG23 ' A' ' 90' ' ' THR . 64.5 m -110.79 109.37 19.56 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.143 0.497 . . . . 9.83 111.505 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.722 HG21 HG13 ' B' ' 13' ' ' ILE . 22.5 m -83.78 100.01 10.65 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.823 -0.806 . . . . 10.84 108.823 178.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.437 ' HB3' ' SD ' ' A' ' 88' ' ' MET . 6.0 m-20 -84.68 101.57 12.28 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.989 -0.55 . . . . 11.26 111.549 -178.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.44 HG23 ' HB2' ' A' ' 11' ' ' GLU . 2.5 m -103.87 121.1 42.37 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.98 -0.555 . . . . 11.22 109.791 178.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . 0.716 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 6.3 t-20 -75.87 125.26 28.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.939 0.4 . . . . 12.78 110.826 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 61.7 t -98.55 -49.47 11.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.728 -0.669 . . . . 14.64 109.929 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.538 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 52.1 mtpt . . . . . 0 C--O 1.252 1.194 0 CA-C-O 118.483 -0.77 . . . . 16.02 110.388 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 72.4 m . . . . . 0 N--CA 1.477 0.88 0 CA-C-O 120.871 0.367 . . . . 7.49 110.23 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' GLN . . . . . 0.55 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 71.6 mm-40 -95.08 142.3 24.42 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.026 -0.534 . . . . 7.12 110.997 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' B' ' 8' ' ' GLN . 10.8 Cg_exo -72.87 171.99 16.29 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 123.099 2.533 . . . . 6.18 111.757 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.91 56.48 3.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.312 0.577 . . . . 5.81 111.082 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.66 ' HA ' ' O ' ' B' ' 110' ' ' ASN . 0.0 OUTLIER -162.85 141.74 8.69 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.399 -0.963 . . . . 5.85 108.399 179.722 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -152.47 165.73 34.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.334 0.588 . . . . 6.08 112.274 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.722 HG13 HG21 ' A' ' 109' ' ' THR . 9.1 mm -90.57 118.07 35.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 114.857 -1.065 . . . . 5.57 110.329 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.665 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.7 OUTLIER -106.31 94.49 5.18 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.773 -0.649 . . . . 5.3 110.293 179.639 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . 0.562 ' HG2' HG12 ' B' ' 107' ' ' ILE . 55.8 mtp180 -87.58 101.89 14.06 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.273 -0.64 . . . . 8.97 109.273 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' B' ' 105' ' ' TYR . 35.0 p80 -132.21 162.07 31.85 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.132 -0.486 . . . . 8.31 110.551 -179.064 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -83.17 177.91 8.34 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.517 -0.311 . . . . 10.83 110.291 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 26.6 pt -60.91 -20.88 22.8 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 113.24 0.83 . . . . 8.89 113.24 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -83.69 -14.42 51.8 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.196 0.522 . . . . 11.92 110.601 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 104.14 -6.34 46.72 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.486 -0.864 . . . . 8.57 111.901 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . 0.542 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 26.9 mm -70.03 117.21 12.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 110.021 -0.362 . . . . 10.87 110.021 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . 0.665 ' HE1' ' HB3' ' B' ' 14' ' ' SER . 97.0 m-85 -73.4 133.07 43.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.201 0.524 . . . . 8.23 111.829 -179.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -103.89 -35.3 8.2 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.479 -0.782 . . . . 7.91 110.018 178.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -148.04 129.55 14.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.794 -0.639 . . . . 7.89 110.246 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . 0.568 HG21 ' HB2' ' B' ' 40' ' ' LEU . 12.4 t -124.23 126.49 72.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.479 -0.563 . . . . 6.1 109.479 179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -67.76 156.06 37.86 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.975 0.416 . . . . 7.15 110.765 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -62.59 -19.21 63.51 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.842 -0.617 . . . . 8.97 112.2 -178.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . 0.55 ' HG2' ' HB3' ' B' ' 8' ' ' GLN . 70.3 mtm180 -64.78 -16.73 63.42 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.839 0.311 . . . . 9.76 111.839 -179.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 30.3 p -60.77 -32.62 71.93 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 120.872 0.368 . . . . 11.56 111.099 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.653 HG13 HE22 ' B' ' 36' ' ' GLN . 18.1 t -64.51 -36.22 76.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 13.64 111.076 -179.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.49 -19.13 31.67 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.985 0.422 . . . . 12.9 110.811 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 20.1 m -84.52 -57.93 2.94 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.152 -0.476 . . . . 12.13 111.889 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' VAL . . . . . 0.464 HG11 ' HD2' ' B' ' 78' ' ' PHE . 6.2 m -122.24 -5.01 8.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 N-CA-C 112.373 0.509 . . . . 13.87 112.373 -178.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.86 -18.21 36.51 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.471 -0.871 . . . . 13.79 112.962 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -67.05 136.96 56.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.734 0.302 . . . . 15.38 110.919 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . 0.653 HE22 HG13 ' B' ' 30' ' ' VAL . 33.5 mm-40 -80.57 151.65 71.83 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 109.144 -0.687 . . . . 13.78 109.144 178.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.516 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 74.5 Cg_exo -50.61 -44.31 40.95 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.845 2.363 . . . . 14.71 112.864 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -65.11 -24.95 67.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.079 -0.509 . . . . 17.54 112.164 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.633 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 30.6 mt-10 -69.19 -25.82 64.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.805 0.336 . . . . 14.24 111.061 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.568 ' HB2' HG21 ' B' ' 25' ' ' VAL . 2.2 mm? -94.84 -21.27 18.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.226 -0.443 . . . . 14.03 110.873 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 52.5 mt -61.87 119.24 8.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.217 -0.447 . . . . 13.62 110.826 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 82.14 10.07 84.29 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.862 -0.685 . . . . 11.62 112.511 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.687 ' HE2' ' HA ' ' B' ' 43' ' ' LYS . 8.7 mmpt? -117.0 156.24 27.82 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 110.153 -0.314 . . . . 13.82 110.153 179.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' ASN . . . . . 0.731 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 13.5 m120 -93.29 135.93 34.04 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.153 -0.476 . . . . 10.16 109.91 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . 0.42 ' HB ' ' CZ ' ' B' ' 22' ' ' PHE . 15.4 tt -59.71 -26.27 34.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.285 0.564 . . . . 9.62 110.847 178.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' VAL . . . . . 0.401 HG12 ' HB3' ' B' ' 44' ' ' ASN . 9.8 p -71.17 -22.05 22.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.844 -0.616 . . . . 11.5 111.243 -179.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . 0.731 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 44.2 mt-10 -70.63 -30.04 66.58 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.968 0.413 . . . . 11.89 110.668 -179.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' PHE . . . . . 0.416 ' HE1' ' HB3' ' B' ' 43' ' ' LYS . 40.4 m-85 -105.37 21.06 17.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.933 -0.576 . . . . 13.6 110.447 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 53.4 t -104.52 151.98 22.93 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 116.004 -0.544 . . . . 10.81 110.411 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' HIS . . . . . 0.432 ' CD2' ' HD2' ' B' ' 51' ' ' PRO . 10.4 t-80 -61.61 126.54 87.03 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.817 -0.629 . . . . 11.49 109.542 178.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' PRO . . . . . 0.432 ' HD2' ' CD2' ' B' ' 50' ' ' HIS . 76.0 Cg_exo -42.55 -50.32 5.85 Favored 'Trans proline' 0 CA--C 1.533 0.439 0 C-N-CA 123.62 2.88 . . . . 11.35 114.143 -179.354 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -75.98 2.98 11.19 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.649 0.611 . . . . 9.28 112.649 -179.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -126.27 3.26 7.07 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.997 0.427 . . . . 7.52 110.841 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -67.6 -37.55 82.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.822 -0.626 . . . . 6.57 110.692 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 47.8 tp60 -65.86 -40.84 92.07 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.994 -0.743 . . . . 6.58 108.994 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.513 HD23 ' HB3' ' B' ' 76' ' ' PHE . 32.1 tp -57.2 -45.07 84.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.132 -0.94 . . . . 4.6 110.713 178.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.453 ' HA ' HD23 ' B' ' 57' ' ' LEU . 1.0 OUTLIER -61.02 -50.33 73.78 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.053 -0.521 . . . . 6.4 110.739 179.645 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 55.3 ttt180 -59.82 -45.39 92.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.783 -0.644 . . . . 8.18 110.925 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -62.0 -45.32 94.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.926 -0.579 . . . . 6.07 110.985 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 23.4 m -63.33 -37.85 88.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.219 -0.446 . . . . 5.59 110.684 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 61' ' ' PHE . . . . . 0.504 ' O ' HG12 ' B' ' 64' ' ' VAL . 4.3 m-30 -65.08 -41.0 95.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.379 -0.373 . . . . 7.73 110.411 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -63.9 -39.02 93.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.98 0.419 . . . . 6.89 110.273 179.184 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.438 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 39.2 mt-30 -69.11 -40.48 78.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.976 -0.556 . . . . 9.4 111.792 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.504 HG12 ' O ' ' B' ' 61' ' ' PHE . 4.0 p -67.19 -25.39 33.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-O 120.767 0.317 . . . . 7.57 111.11 -179.278 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . 0.508 ' HA ' HG21 ' B' ' 94' ' ' THR . 51.7 t -69.21 -35.83 69.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 109.263 -0.643 . . . . 7.43 109.263 178.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -70.48 -36.06 73.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.511 -0.768 . . . . 10.21 110.093 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' B' ' 63' ' ' GLN . 69.8 mt -65.56 -43.86 88.52 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.119 -0.697 . . . . 7.2 109.119 178.654 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 65.9 tttt 47.29 90.57 0.02 OUTLIER 'General case' 0 C--O 1.235 0.298 0 CA-C-N 114.801 -1.09 . . . . 7.58 112.837 178.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 108.6 1.59 32.67 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.552 -0.832 . . . . 5.57 112.334 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -114.94 165.34 12.97 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.986 -0.376 . . . . 5.43 109.986 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 6.6 t -108.14 127.13 64.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.067 0.461 . . . . 5.65 111.118 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 42.0 tp -119.52 103.11 9.14 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.567 -0.742 . . . . 4.51 109.062 178.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . 0.575 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.3 p -86.64 112.59 21.76 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.046 -0.525 . . . . 6.35 111.228 -179.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 p -107.04 127.16 62.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.704 -0.68 . . . . 4.34 109.927 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 28.7 ttt -100.54 110.33 22.49 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.08 0.467 . . . . 5.42 110.815 -179.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.513 ' HB3' HD23 ' B' ' 56' ' ' LEU . 51.9 p90 -137.14 -173.16 3.38 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.729 -0.669 . . . . 3.54 109.368 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 77' ' ' ARG . . . . . 0.483 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 50.6 mtm180 -105.15 119.48 39.16 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.148 0.499 . . . . 6.8 110.507 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.464 ' HD2' HG11 ' B' ' 33' ' ' VAL . 16.8 t80 -102.49 148.84 25.03 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.2 -0.909 . . . . 5.79 110.339 -179.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 79' ' ' ARG . . . . . 0.649 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 3.6 ttp180 -90.06 124.27 34.64 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.205 -0.452 . . . . 11.08 110.185 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . 0.499 ' HB3' HD21 ' B' ' 86' ' ' LEU . 95.0 p -91.52 -175.23 4.14 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.579 -0.526 . . . . 7.47 109.579 178.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -65.16 -16.6 63.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.113 0.482 . . . . 12.24 110.479 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -89.23 -0.22 57.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.13 -0.486 . . . . 9.25 110.458 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 69.16 12.59 8.53 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.7 -0.682 . . . . 8.3 111.678 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -89.96 154.85 19.53 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.937 -0.394 . . . . 6.78 109.937 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . 0.649 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 57.2 m95 -97.86 108.48 21.2 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.31 -0.405 . . . . 7.89 111.371 -178.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.499 HD21 ' HB3' ' B' ' 80' ' ' SER . 1.9 pp -109.31 147.52 32.54 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.071 -0.513 . . . . 6.97 110.176 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 87' ' ' TRP . . . . . 0.764 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 87.3 m95 -77.74 118.66 20.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.106 0.479 . . . . 8.55 110.231 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 7.3 tpp -123.32 135.07 54.02 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.589 -0.732 . . . . 4.46 111.319 -178.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 37.5 ttp180 -96.17 89.55 5.18 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.633 -0.877 . . . . 6.87 108.633 178.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 90' ' ' THR . . . . . 0.687 HG23 ' HB3' ' B' ' 108' ' ' CYS . 27.4 m -78.29 104.01 8.6 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.867 -0.606 . . . . 6.18 111.111 -179.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 91' ' ' SER . . . . . 0.588 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 1.8 m -85.63 91.0 8.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.875 -0.602 . . . . 6.3 109.707 179.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 9.3 m -78.53 122.22 25.6 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.814 -0.63 . . . . 6.65 111.58 -178.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -122.09 121.74 37.64 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.095 -0.502 . . . . 6.45 110.082 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . 0.508 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.1 OUTLIER -82.23 110.25 17.25 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.449 -0.341 . . . . 9.17 110.395 179.483 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.68 126.51 30.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.138 0.494 . . . . 8.33 110.552 -179.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -96.26 119.05 34.03 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.555 -0.748 . . . . 10.53 110.446 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 97' ' ' ASN . . . . . 0.418 ' HB3' ' OE1' ' B' ' 102' ' ' GLU . 52.3 t30 -68.44 126.04 92.29 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.184 -0.673 . . . . 8.43 109.184 178.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.48 4.5 2.46 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 123.095 2.53 . . . . 9.16 114.084 -178.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -86.34 -70.56 0.6 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.843 0.354 . . . . 11.34 111.483 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -129.85 27.07 5.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.604 -0.271 . . . . 7.75 111.039 -179.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 33.8 t70 60.36 49.29 7.09 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.585 0.707 . . . . 9.08 110.215 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . 0.418 ' OE1' ' HB3' ' B' ' 97' ' ' ASN . 3.3 mp0 -97.8 153.92 17.97 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.876 -0.602 . . . . 7.71 110.123 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 46.0 mt -95.84 96.17 5.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 109.506 -0.553 . . . . 8.04 109.506 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -68.02 -47.83 67.37 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.995 -0.548 . . . . 8.81 110.819 -179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 105' ' ' TYR . . . . . 0.44 ' HB2' ' O ' ' B' ' 16' ' ' HIS . 8.8 p90 -167.93 178.39 5.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.406 -0.361 . . . . 7.4 110.41 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 54.0 mt -120.44 115.96 48.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.89 -0.596 . . . . 6.78 110.093 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.562 HG12 ' HG2' ' B' ' 15' ' ' ARG . 19.7 mt -91.25 119.67 38.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 109.36 -0.608 . . . . 6.31 109.36 179.463 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 108' ' ' CYS . . . . . 0.687 ' HB3' HG23 ' B' ' 90' ' ' THR . 71.4 m -111.43 117.88 34.28 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.909 0.385 . . . . 5.31 111.812 -179.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . 0.588 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 28.9 m -81.54 97.75 7.97 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.965 -1.124 . . . . 5.48 107.965 177.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 110' ' ' ASN . . . . . 0.66 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.5 m-20 -79.39 102.1 8.5 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.708 -0.678 . . . . 6.9 110.906 -178.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.04 113.25 26.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.261 -0.427 . . . . 8.61 110.61 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -68.89 132.42 46.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.82 0.343 . . . . 11.84 110.558 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 113' ' ' VAL . . . . . 0.414 HG12 ' HG3' ' B' ' 114' ' ' LYS . 52.7 t -111.8 -46.18 5.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.987 -0.552 . . . . 11.77 110.239 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . 0.764 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 59.4 mtpt . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.568 -0.729 . . . . 12.68 109.927 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.534 ' HB2' ' CB ' ' A' ' 31' ' ' ALA . 49.8 mm-40 . . . . . 0 N--CA 1.454 -0.229 0 N-CA-C 110.032 -0.359 . . . . 15.08 110.032 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.31 170.99 18.91 Favored 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 122.545 2.163 . . . . 13.43 112.332 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.604 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.1 OUTLIER -84.15 50.83 1.93 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.031 -0.531 . . . . 11.09 111.13 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.514 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 3.6 tm-20 -153.61 137.88 16.59 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.591 -0.731 . . . . 10.59 109.036 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.877 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 26.9 p90 -153.22 142.96 21.99 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.091 0.472 . . . . 8.93 110.874 179.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 50.3 mm -82.02 120.57 33.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.795 -0.639 . . . . 8.66 111.083 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.773 ' HB3' ' HE1' ' A' ' 22' ' ' PHE . 1.6 m -103.2 94.24 5.42 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.907 -0.588 . . . . 6.11 110.551 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.604 ' HD3' ' HB3' ' A' ' 24' ' ' PHE . 10.5 mtp180 -85.73 97.25 10.04 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.411 -0.588 . . . . 9.09 109.411 179.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 30.9 p80 -127.66 154.28 45.47 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.682 -0.69 . . . . 9.79 110.251 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.6 p-10 -73.61 178.18 4.89 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.525 -0.307 . . . . 12.69 110.427 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.6 pt -56.63 -28.95 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 112.815 0.672 . . . . 13.58 112.815 -179.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -77.57 -17.2 58.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.892 0.377 . . . . 13.85 111.399 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 105.79 -3.22 38.9 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.596 -0.811 . . . . 9.38 112.687 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.501 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 18.2 mm -71.62 117.15 14.51 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-O 120.764 0.316 . . . . 10.74 110.687 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.773 ' HE1' ' HB3' ' A' ' 14' ' ' SER . 98.6 m-85 -69.89 125.33 26.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.131 -0.486 . . . . 9.73 110.324 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 m -109.42 -21.55 12.45 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.358 0.599 . . . . 7.74 109.96 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.604 ' HB3' ' HD3' ' A' ' 15' ' ' ARG . 23.7 t80 -151.86 116.43 5.09 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.882 -0.784 . . . . 6.92 108.882 178.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.629 HG21 ' HB2' ' A' ' 40' ' ' LEU . 3.0 t -109.94 153.1 11.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-O 120.854 0.359 . . . . 6.02 110.917 -178.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.877 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 5.0 t70 -72.0 172.54 9.84 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.91 -0.587 . . . . 7.31 110.358 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -96.83 -25.01 15.62 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.319 0.58 . . . . 11.67 109.817 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 54.3 mtm180 -76.11 -4.34 40.99 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.485 -0.779 . . . . 11.91 112.371 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.9 p -59.25 -27.71 66.05 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 120.843 0.354 . . . . 12.99 111.544 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.432 ' O ' ' HA2' ' A' ' 34' ' ' GLY . 24.4 t -62.57 -34.94 67.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.98 -0.555 . . . . 16.15 110.923 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.534 ' CB ' ' HB2' ' A' ' 8' ' ' GLN . . . -93.48 -6.28 47.25 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.875 0.369 . . . . 15.07 111.011 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.8 m -90.99 -55.55 3.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.996 0.427 . . . . 14.9 110.304 179.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.541 HG11 ' HD2' ' A' ' 78' ' ' PHE . 3.7 m -123.56 -21.25 3.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.905 -0.589 . . . . 13.84 111.42 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.432 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 101.73 -17.49 54.71 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.391 -0.909 . . . . 13.85 112.147 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.466 ' H ' HG23 ' A' ' 33' ' ' VAL . 7.3 m-85 -71.41 137.2 48.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.806 0.336 . . . . 18.28 110.554 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.425 HE22 HG13 ' A' ' 30' ' ' VAL . 34.1 mm-40 -79.25 152.23 76.08 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.197 -0.668 . . . . 15.48 109.197 179.026 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.519 ' HB3' ' HB ' ' A' ' 25' ' ' VAL . 50.8 Cg_exo -53.89 -38.65 86.06 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.454 2.103 . . . . 11.63 112.168 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.42 ' HA ' HD12 ' A' ' 41' ' ' LEU . 26.2 mp0 -68.48 -16.61 63.95 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.833 -0.621 . . . . 13.31 111.624 -179.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.17 -23.48 35.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.991 0.424 . . . . 17.34 109.909 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.629 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.6 mm? -92.67 -32.24 14.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.874 -0.603 . . . . 13.25 110.288 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 86.8 mt -54.92 119.15 4.98 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.091 -0.504 . . . . 12.99 111.496 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.47 4.97 85.35 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.855 -0.688 . . . . 13.39 112.984 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.636 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 7.7 mmpt? -114.78 157.93 22.57 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 122.556 -0.379 . . . . 16.87 110.556 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.696 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 16.1 m120 -92.4 134.19 35.17 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.672 -0.492 . . . . 12.5 109.672 179.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.48 HD13 ' HZ ' ' A' ' 61' ' ' PHE . 11.3 tt -56.63 -30.39 31.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.991 0.424 . . . . 11.72 111.452 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.8 p -70.53 -17.94 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-N 116.247 -0.433 . . . . 12.89 111.753 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.696 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.2 mt-10 -72.48 -34.21 67.53 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.958 0.408 . . . . 16.53 110.431 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.456 ' HE1' ' HB3' ' A' ' 43' ' ' LYS . 68.3 m-85 -99.87 21.16 13.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.807 -0.633 . . . . 15.34 110.299 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 13.2 t -108.06 150.49 27.09 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.781 -0.645 . . . . 11.97 110.733 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.532 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 2.1 t-160 -56.09 128.17 71.23 Favored Pre-proline 0 C--N 1.333 -0.139 0 N-CA-C 109.019 -0.734 . . . . 14.67 109.019 178.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.429 ' HD2' ' CD2' ' A' ' 50' ' ' HIS . 5.7 Cg_endo -50.37 -40.91 52.82 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 122.777 2.318 . . . . 15.15 112.828 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -75.51 -14.55 60.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.484 -0.326 . . . . 16.47 111.36 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.532 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 34.5 m-20 -103.39 -6.63 21.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.605 -0.27 . . . . 13.16 111.203 -179.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -56.59 -42.56 78.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 15.83 111.344 -179.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 49.0 tp60 -64.68 -45.28 87.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.43 -0.35 . . . . 13.94 110.425 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.9 tp -59.55 -42.44 92.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.998 -0.546 . . . . 12.11 110.505 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.494 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.5 OUTLIER -63.16 -54.5 36.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.081 -0.509 . . . . 9.71 110.617 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 56.4 ttt180 -58.53 -41.02 84.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.08 -0.509 . . . . 11.06 110.919 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.38 -43.33 96.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.958 -0.564 . . . . 9.71 110.579 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.6 m -70.19 -32.58 70.57 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.791 -0.64 . . . . 9.52 111.148 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.548 ' O ' HG12 ' A' ' 64' ' ' VAL . 8.3 m-85 -62.09 -50.39 72.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.948 0.404 . . . . 11.4 110.488 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -67.86 -30.77 70.23 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.707 -0.479 . . . . 10.04 109.707 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -63.17 -45.32 92.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.633 -0.712 . . . . 10.6 110.915 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.548 HG12 ' O ' ' A' ' 61' ' ' PHE . 1.9 p -67.2 -24.1 31.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-O 120.813 0.34 . . . . 10.62 110.576 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.467 ' O ' ' HG3' ' A' ' 68' ' ' LYS . 69.3 t -72.43 -38.93 61.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 108.963 -0.754 . . . . 12.41 108.963 178.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 42.1 mtpt -73.46 -30.36 63.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.377 -0.829 . . . . 16.25 109.766 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 22.0 mt -68.36 -57.45 5.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.558 -0.747 . . . . 12.66 110.33 179.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 65' ' ' VAL . 67.7 mttt 62.97 83.47 0.16 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.685 -0.689 . . . . 14.83 112.175 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.51 -47.72 1.0 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.579 -0.82 . . . . 9.8 113.127 178.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -71.6 136.22 47.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.944 0.402 . . . . 9.59 110.599 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.522 ' HB ' ' HZ ' ' B' ' 24' ' ' PHE . 4.1 p -80.44 123.94 37.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.611 -0.722 . . . . 8.1 110.229 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 25.2 tp -107.14 109.56 21.42 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.067 0.461 . . . . 7.8 110.569 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.428 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 1.3 m -89.56 109.04 20.02 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.796 -0.638 . . . . 7.59 110.923 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 p -103.8 129.71 55.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.403 -0.362 . . . . 7.84 110.082 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 26.2 ttt -104.28 115.08 29.76 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.096 0.474 . . . . 9.35 110.433 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.565 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 31.6 p90 -145.86 178.58 8.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.797 -0.638 . . . . 9.66 109.975 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.806 ' HB3' ' HB3' ' A' ' 85' ' ' TRP . 9.0 mtt180 -98.14 116.51 30.51 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.836 0.35 . . . . 13.1 110.472 179.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.565 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 19.4 t80 -100.95 147.29 26.33 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.107 -0.497 . . . . 9.28 109.897 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.424 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 37.9 ttp180 -81.91 132.59 35.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.858 0.361 . . . . 10.87 111.001 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.469 ' HA ' ' HB ' ' A' ' 33' ' ' VAL . 54.6 p -95.94 -176.69 3.78 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.078 -0.51 . . . . 10.77 110.108 179.142 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.5 tptt -69.64 -18.74 63.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.344 0.592 . . . . 12.66 109.614 178.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 -91.38 5.33 49.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.634 -0.712 . . . . 14.42 109.685 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 65.51 23.71 11.83 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.115 -0.948 . . . . 12.69 111.659 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -98.71 164.89 12.05 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.123 -0.695 . . . . 10.85 109.123 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.806 ' HB3' ' HB3' ' A' ' 77' ' ' ARG . 55.2 m95 -109.61 112.63 24.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.133 0.492 . . . . 11.2 111.29 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.485 HD21 HG12 ' A' ' 33' ' ' VAL . 1.3 pp -108.66 150.31 27.72 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.77 -0.65 . . . . 11.12 110.17 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -76.34 116.35 16.94 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.019 0.437 . . . . 10.28 110.487 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 18.2 tpp -116.86 129.05 55.83 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.75 -0.659 . . . . 9.32 110.718 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.3 ttp180 -100.66 77.4 1.89 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.471 -0.937 . . . . 10.66 108.471 178.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.412 HG23 ' HB3' ' A' ' 108' ' ' CYS . 61.2 m -69.54 108.37 3.78 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.353 -0.84 . . . . 9.37 113.033 -177.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.449 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 1.5 m -86.78 95.1 9.72 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.947 -0.76 . . . . 8.27 108.947 177.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.3 m -83.63 130.71 34.98 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.005 0.372 . . . . 8.65 112.005 -178.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -124.58 129.07 49.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.714 -0.675 . . . . 11.56 110.057 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.38 115.23 15.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.29 -0.414 . . . . 10.16 111.001 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -89.99 106.18 18.3 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.968 0.413 . . . . 12.25 110.314 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.616 ' HG2' HG12 ' A' ' 103' ' ' ILE . 16.6 mt-30 -114.8 156.93 23.98 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.776 -0.647 . . . . 14.24 110.689 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.433 ' HB2' ' OE2' ' A' ' 102' ' ' GLU . 92.1 m-20 -95.2 149.09 35.7 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 109.096 -0.705 . . . . 13.83 109.096 178.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -83.15 18.42 1.5 Allowed 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 122.581 2.187 . . . . 15.34 112.58 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -97.71 -66.57 0.89 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.369 -0.378 . . . . 16.89 110.903 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.4 m -126.01 20.28 7.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.459 -0.337 . . . . 14.89 110.522 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.7 t70 60.41 33.51 20.7 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.715 -0.675 . . . . 14.77 110.94 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.433 ' OE2' ' HB2' ' A' ' 97' ' ' ASN . 0.5 OUTLIER -78.05 136.9 38.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.936 -0.575 . . . . 12.95 110.154 -179.826 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.616 HG12 ' HG2' ' A' ' 96' ' ' GLN . 45.8 mt -94.0 114.19 30.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.84 -0.43 . . . . 11.11 109.84 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -77.32 -53.56 7.55 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.828 0.347 . . . . 11.65 110.78 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 15.4 p90 -158.17 -178.27 7.17 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.271 -0.422 . . . . 10.3 110.525 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 24.4 mt -113.34 116.16 51.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.96 -0.564 . . . . 10.29 110.072 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 59.3 mt -83.21 100.1 6.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.14 -0.482 . . . . 8.99 109.875 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.432 ' HB2' ' HB2' ' A' ' 14' ' ' SER . 51.8 m -94.68 114.71 26.67 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.243 -0.435 . . . . 9.83 111.33 -179.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.449 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 4.0 m -87.51 93.02 9.29 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.912 -0.773 . . . . 10.84 108.912 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.514 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 6.2 m-20 -78.3 99.23 6.22 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.849 -0.614 . . . . 11.26 112.019 -178.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.796 HG21 HH12 ' B' ' 28' ' ' ARG . 0.7 OUTLIER -107.22 117.74 34.87 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.883 -0.414 . . . . 11.22 109.883 178.306 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . 0.604 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 8.5 t-20 -76.53 130.13 37.47 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.016 0.436 . . . . 12.78 110.975 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 28.9 t -104.77 -54.79 6.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 115.622 -0.717 . . . . 14.64 109.576 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 46.7 mtpt . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.141 -0.933 . . . . 16.02 110.006 -179.656 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 77.2 m . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 110.173 -0.306 . . . . 7.49 110.173 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -120.72 151.5 54.51 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 116.565 -0.289 . . . . 7.12 110.224 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -66.06 161.13 41.24 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.751 2.3 . . . . 6.18 112.664 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . 0.475 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.3 OUTLIER -82.09 59.81 4.59 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.834 -0.621 . . . . 5.81 111.364 -179.499 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.525 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -156.38 153.28 28.69 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.811 -0.811 . . . . 5.85 108.811 179.184 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -158.83 158.54 33.68 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.137 0.494 . . . . 6.08 111.358 179.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.583 ' HB ' ' HB2' ' B' ' 26' ' ' ASP . 21.5 mm -93.35 117.05 35.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.541 -0.754 . . . . 5.57 110.09 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.672 ' HB3' ' HE2' ' B' ' 22' ' ' PHE . 0.6 OUTLIER -107.32 96.31 6.32 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.094 -0.503 . . . . 5.3 111.303 -179.084 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . 0.666 ' HD3' ' HB3' ' B' ' 24' ' ' PHE . 23.5 mtp85 -90.66 107.7 19.34 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.908 -0.775 . . . . 8.97 108.908 179.046 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . 0.468 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 31.3 p80 -136.98 165.55 25.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.63 -0.259 . . . . 8.31 111.45 -178.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -77.94 177.33 8.34 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 116.038 -0.528 . . . . 10.83 110.245 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 22.8 pt -58.11 -30.48 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 N-CA-C 112.917 0.71 . . . . 8.89 112.917 -178.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -78.63 -16.85 56.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.08 0.467 . . . . 11.92 111.495 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 108.16 -1.12 33.25 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.432 -0.89 . . . . 8.57 112.359 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . 0.508 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 33.1 mm -69.56 111.87 3.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 N-CA-C 109.805 -0.443 . . . . 10.87 109.805 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . 0.672 ' HE2' ' HB3' ' B' ' 14' ' ' SER . 57.1 m-85 -63.57 126.72 28.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.248 -0.433 . . . . 8.23 110.972 -179.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 1.4 m -100.64 -33.37 10.32 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.957 -0.565 . . . . 7.91 110.237 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . 0.666 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 32.3 t80 -156.62 127.33 6.72 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.693 -0.685 . . . . 7.89 109.437 179.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 15.0 t -115.02 138.3 45.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.434 -0.348 . . . . 6.1 110.672 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . 0.583 ' HB2' ' HB ' ' B' ' 13' ' ' ILE . 9.6 t70 -75.02 141.65 43.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.058 -0.519 . . . . 7.15 109.698 179.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 18.4 m170 -70.4 87.54 0.63 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.05 0.453 . . . . 8.97 110.185 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . 0.796 HH12 HG21 ' A' ' 111' ' ' THR . 12.5 mtm180 -169.53 -21.57 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.022 -0.99 . . . . 9.76 110.408 -179.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' CYS . . . . . 0.419 ' H ' ' H ' ' B' ' 28' ' ' ARG . 24.3 p -55.86 -30.53 61.65 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.601 0.593 . . . . 11.56 112.601 -178.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.4 ' O ' ' HA2' ' B' ' 34' ' ' GLY . 3.2 t -68.36 -21.84 26.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.138 0.494 . . . . 13.64 110.782 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -96.25 -19.49 19.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.151 -0.477 . . . . 12.9 110.039 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 2.5 m -85.61 -60.02 2.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.978 -0.555 . . . . 12.13 111.303 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' VAL . . . . . 0.523 HG11 ' HD2' ' B' ' 78' ' ' PHE . 3.5 m -116.58 -14.52 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.808 0.337 . . . . 13.87 111.586 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' GLY . . . . . 0.4 ' HA2' ' O ' ' B' ' 30' ' ' VAL . . . 91.82 -2.96 77.27 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.503 -0.856 . . . . 13.79 112.817 179.379 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' TYR . . . . . 0.443 ' H ' HG23 ' B' ' 33' ' ' VAL . 5.4 m-85 -82.32 137.8 34.7 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.716 0.293 . . . . 15.38 110.62 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . 0.827 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 77.5 mm-40 -73.21 146.75 87.27 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 116.092 -0.504 . . . . 13.78 109.769 179.114 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.566 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 51.1 Cg_exo -53.89 -39.76 83.28 Favored 'Trans proline' 0 CA--C 1.529 0.27 0 C-N-CA 122.38 2.053 . . . . 14.71 112.125 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -69.34 -14.52 62.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.849 -0.614 . . . . 17.54 111.864 -179.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.827 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 29.3 mt-10 -82.72 -21.07 34.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.94 0.4 . . . . 14.24 110.368 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.46 ' HB3' ' CG ' ' B' ' 22' ' ' PHE . 1.2 mm? -94.57 -28.5 15.37 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.802 -0.635 . . . . 14.03 110.016 179.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 87.1 mt -62.71 119.21 8.84 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.986 -0.552 . . . . 13.62 110.692 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 90.24 -2.98 81.97 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.911 -0.661 . . . . 11.62 112.097 -179.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.508 ' O ' ' HA ' ' B' ' 21' ' ' ILE . 1.5 mmpt? -109.14 161.66 15.0 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.681 0.277 . . . . 13.82 110.29 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' ASN . . . . . 0.788 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 15.4 m120 -96.63 135.24 38.81 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.484 -0.562 . . . . 10.16 109.484 179.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.1 tt -60.68 -22.65 26.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.224 0.535 . . . . 9.62 110.75 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' VAL . . . . . 0.4 HG12 ' HB3' ' B' ' 44' ' ' ASN . 9.9 p -74.59 -18.19 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 116.052 -0.522 . . . . 11.5 111.196 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . 0.788 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 36.5 mt-10 -73.85 -38.25 64.55 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.959 0.409 . . . . 11.89 110.877 -179.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' PHE . . . . . 0.506 ' HB2' ' CZ ' ' B' ' 78' ' ' PHE . 25.4 m-85 -96.34 18.28 14.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.018 -0.537 . . . . 13.6 110.575 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 51.9 t -103.11 149.56 24.49 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.071 -0.513 . . . . 10.81 110.647 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' HIS . . . . . 0.668 ' HB3' ' HB2' ' B' ' 53' ' ' ASP . 9.3 t-160 -57.19 127.63 76.7 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.663 -0.699 . . . . 11.49 109.17 178.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_exo -45.06 -50.8 8.37 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.083 2.522 . . . . 11.35 113.438 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 13.5 mp0 -75.08 4.15 7.26 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.447 0.536 . . . . 9.28 112.447 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . 0.668 ' HB2' ' HB3' ' B' ' 50' ' ' HIS . 6.0 m-20 -122.46 -0.22 9.3 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.108 0.48 . . . . 7.52 110.341 179.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -66.69 -38.37 86.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.802 -0.635 . . . . 6.57 110.794 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 48.1 tp60 -65.65 -45.21 83.84 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.682 -0.488 . . . . 6.58 109.682 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 40.7 tp -58.77 -42.49 89.07 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.482 -0.781 . . . . 4.6 110.573 179.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.517 ' HA ' HD23 ' B' ' 57' ' ' LEU . 1.1 mt -63.02 -54.55 36.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.032 -0.531 . . . . 6.4 110.777 179.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 42.2 ttt180 -58.36 -43.63 88.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 8.18 111.059 -179.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -60.14 -46.04 91.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.042 -0.526 . . . . 6.07 110.645 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 42.5 m -63.92 -39.02 93.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.069 -0.514 . . . . 5.59 110.726 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 61' ' ' PHE . . . . . 0.457 ' O ' HG12 ' B' ' 64' ' ' VAL . 9.7 m-85 -62.95 -44.13 96.91 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.829 0.347 . . . . 7.73 110.287 179.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -66.93 -35.0 79.0 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.309 -0.405 . . . . 6.89 110.375 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.407 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 27.2 mt-30 -69.92 -40.76 75.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.109 -0.496 . . . . 9.4 111.593 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.457 ' HA ' HD12 ' B' ' 67' ' ' LEU . 9.8 p -70.02 -25.96 28.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 120.917 0.389 . . . . 7.57 110.832 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . 0.625 ' HA ' HG21 ' B' ' 94' ' ' THR . 24.6 t -68.44 -32.81 56.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.389 0.614 . . . . 7.43 109.407 178.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -78.53 -11.49 59.96 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.475 -0.784 . . . . 10.21 110.85 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.624 ' HB3' ' HB2' ' B' ' 70' ' ' GLN . 96.8 mt -82.7 -55.7 4.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.128 -0.487 . . . . 7.2 109.996 179.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 79.8 mttt 66.18 111.22 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.492 -0.777 . . . . 7.58 111.702 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . 0.433 ' HA3' ' OE1' ' B' ' 96' ' ' GLN . . . 75.98 19.54 78.63 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.626 -0.797 . . . . 5.57 112.291 179.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . 0.624 ' HB2' ' HB3' ' B' ' 67' ' ' LEU . 26.6 mm-40 -128.45 163.66 24.42 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.665 -0.495 . . . . 5.43 109.665 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 71' ' ' VAL . . . . . 0.443 ' HB ' ' HD1' ' B' ' 93' ' ' PHE . 9.8 p -116.72 131.16 70.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 121.27 0.557 . . . . 5.65 111.068 -179.232 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 21.0 tp -118.46 116.02 25.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.932 -0.577 . . . . 4.51 109.616 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.8 m -92.31 114.77 27.41 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.836 -0.62 . . . . 6.35 111.351 -179.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . 0.437 HG13 ' HB ' ' B' ' 90' ' ' THR . 2.5 p -108.04 128.8 63.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.931 -0.577 . . . . 4.34 110.0 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 27.9 ttt -102.16 108.08 19.37 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.032 0.444 . . . . 5.42 110.525 -179.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.426 ' HE2' ' HD1' ' B' ' 78' ' ' PHE . 26.8 p90 -138.49 -171.45 3.06 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.895 -0.593 . . . . 3.54 109.893 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 77' ' ' ARG . . . . . 0.615 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 59.0 mtm180 -114.66 119.29 36.23 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.15 0.5 . . . . 6.8 110.53 179.27 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.523 ' HD2' HG11 ' B' ' 33' ' ' VAL . 19.7 t80 -99.53 144.85 28.15 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.451 -0.795 . . . . 5.79 110.504 -179.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 79' ' ' ARG . . . . . . . . . . . . . 39.7 ttp180 -82.62 120.02 25.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.365 -0.38 . . . . 11.08 110.208 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . 0.486 ' OG ' ' HG2' ' B' ' 84' ' ' GLU . 99.8 p -87.71 -175.21 5.09 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.841 0.353 . . . . 7.47 110.747 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 39.8 tptt -66.37 -16.72 64.29 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.023 -0.535 . . . . 12.24 110.418 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 23.7 m-20 -92.84 4.18 54.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.02 -0.536 . . . . 9.25 109.837 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 68.86 16.36 8.85 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.323 -0.853 . . . . 8.3 112.029 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . 0.486 ' HG2' ' OG ' ' B' ' 80' ' ' SER . 13.4 pt-20 -97.01 148.08 23.35 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.683 -0.488 . . . . 6.78 109.683 179.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . 0.615 ' HB3' ' HB3' ' B' ' 77' ' ' ARG . 2.7 m95 -95.05 103.63 15.49 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.089 -0.337 . . . . 7.89 110.089 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.509 HD21 HG12 ' B' ' 33' ' ' VAL . 1.6 pp -97.45 146.43 25.22 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.515 -0.311 . . . . 6.97 110.645 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 87' ' ' TRP . . . . . 0.59 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 87.0 m95 -72.8 116.97 13.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.392 -0.367 . . . . 8.55 110.111 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 88' ' ' MET . . . . . 0.416 ' SD ' ' HB3' ' B' ' 110' ' ' ASN . 3.9 ttp -131.3 134.57 46.49 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.01 -0.541 . . . . 4.46 110.657 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 37.5 ttp180 -96.98 105.28 17.4 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.72 -0.673 . . . . 6.87 109.353 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 90' ' ' THR . . . . . 0.776 HG23 ' HB3' ' B' ' 108' ' ' CYS . 19.7 m -88.32 106.89 18.53 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.895 -0.593 . . . . 6.18 111.014 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 91' ' ' SER . . . . . 0.454 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 0.8 OUTLIER -87.9 88.58 7.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.827 -0.624 . . . . 6.3 109.321 179.129 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 9.3 m -80.49 122.65 27.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.082 -0.508 . . . . 6.65 111.968 -178.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . 0.443 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 77.6 t80 -115.47 125.46 53.11 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.261 -0.427 . . . . 6.45 109.949 178.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . 0.625 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.4 OUTLIER -88.33 104.3 16.63 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.757 0.313 . . . . 9.17 110.735 179.763 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -71.7 132.45 44.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.307 -0.406 . . . . 8.33 110.541 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 96' ' ' GLN . . . . . 0.433 ' OE1' ' HA3' ' B' ' 69' ' ' GLY . 50.9 mt-30 -99.0 137.65 37.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.851 -0.613 . . . . 10.53 111.851 -178.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 97' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -89.85 124.13 64.51 Favored Pre-proline 0 C--N 1.323 -0.568 0 N-CA-C 108.329 -0.989 . . . . 8.43 108.329 177.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.54 51.19 1.11 Allowed 'Trans proline' 0 CA--C 1.534 0.479 0 C-N-CA 123.137 2.558 . . . . 9.16 113.703 -179.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -138.02 -77.82 0.37 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.547 -0.297 . . . . 11.34 110.425 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 14.7 m -113.24 20.11 16.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.128 0.49 . . . . 7.75 109.908 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.6 t0 61.66 35.03 17.27 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.087 -0.961 . . . . 9.08 111.341 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -82.07 164.93 21.04 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.967 -0.561 . . . . 7.71 109.767 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 69.4 mt -103.33 118.77 50.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.486 -0.324 . . . . 8.04 110.284 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -66.09 -64.26 0.9 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.063 0.458 . . . . 8.81 109.788 179.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 6.6 p90 -157.92 172.47 18.4 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.392 -0.822 . . . . 7.4 109.666 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 57.8 mt -102.96 113.16 38.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.403 -0.362 . . . . 6.78 110.081 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 13.2 mt -88.91 105.52 15.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 109.332 -0.618 . . . . 6.31 109.332 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 108' ' ' CYS . . . . . 0.776 ' HB3' HG23 ' B' ' 90' ' ' THR . 97.1 m -99.25 106.1 18.19 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.375 0.509 . . . . 5.31 112.375 -178.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . 0.454 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 2.9 m -79.89 84.26 5.69 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.647 -0.872 . . . . 5.48 108.647 177.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 110' ' ' ASN . . . . . 0.416 ' HB3' ' SD ' ' B' ' 88' ' ' MET . 7.3 m-20 -71.16 121.71 18.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.552 -0.749 . . . . 6.9 111.752 -178.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.13 116.63 22.36 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.213 -0.448 . . . . 8.61 110.111 179.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 112' ' ' ASN . . . . . 0.475 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 8.1 t-20 -68.44 135.3 51.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.116 0.484 . . . . 11.84 110.875 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 2.0 t -109.12 -50.12 7.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.683 -0.69 . . . . 11.77 109.9 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . 0.59 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 92.0 mttt . . . . . 0 C--O 1.246 0.905 0 CA-C-O 118.61 -0.71 . . . . 12.68 109.829 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.428 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 74.1 mm-40 . . . . . 0 N--CA 1.455 -0.176 0 N-CA-C 109.794 -0.447 . . . . 15.08 109.794 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 8' ' ' GLN . 13.1 Cg_exo -69.57 159.9 51.79 Favored 'Trans proline' 0 C--O 1.233 0.271 0 C-N-CA 122.805 2.337 . . . . 13.43 112.664 -179.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.506 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.0 OUTLIER -86.87 55.77 3.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.853 -0.612 . . . . 11.09 110.233 179.79 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.479 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 8.8 tt0 -157.55 144.06 17.9 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.492 -0.776 . . . . 10.59 109.728 -178.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.818 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 27.2 p90 -150.63 143.58 24.69 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.066 0.46 . . . . 8.93 111.114 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.471 HG23 HG23 ' A' ' 107' ' ' ILE . 50.5 mm -80.0 115.23 22.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.902 -0.59 . . . . 8.66 110.444 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.917 ' HB3' ' HE2' ' A' ' 22' ' ' PHE . 1.6 m -100.21 99.52 10.22 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.986 -0.552 . . . . 6.11 110.94 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.646 ' HD3' ' HB3' ' A' ' 24' ' ' PHE . 15.1 mtp180 -91.72 106.7 18.67 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.419 -0.586 . . . . 9.09 109.419 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.8 p80 -133.73 159.98 38.94 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.507 -0.315 . . . . 9.79 110.887 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -75.82 179.32 5.55 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.336 -0.393 . . . . 12.69 110.618 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.1 pt -53.93 -36.45 30.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 112.528 0.566 . . . . 13.58 112.528 -179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -68.82 -46.47 68.54 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.989 0.424 . . . . 13.85 111.039 -179.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 137.22 -8.46 3.79 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.609 -0.805 . . . . 9.38 111.724 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.463 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 33.5 mm -64.99 116.1 3.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 109.908 -0.405 . . . . 10.74 109.908 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.917 ' HE2' ' HB3' ' A' ' 14' ' ' SER . 89.7 m-85 -66.82 122.33 17.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.156 -0.474 . . . . 9.73 110.885 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.82 -32.59 13.89 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.678 -0.692 . . . . 7.74 109.735 179.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.646 ' HB3' ' HD3' ' A' ' 15' ' ' ARG . 55.1 t80 -147.43 133.63 19.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.517 -0.765 . . . . 6.92 109.337 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.506 HG21 ' HB2' ' A' ' 40' ' ' LEU . 22.1 t -119.41 147.19 23.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.253 0.549 . . . . 6.02 111.606 -178.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.818 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 5.4 t70 -68.8 -179.55 1.47 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 114.911 -1.04 . . . . 7.31 110.499 179.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 25.8 m170 -108.34 -20.29 13.18 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.105 0.479 . . . . 11.67 110.226 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 63.9 mtm180 -76.94 -6.68 53.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.83 -0.623 . . . . 11.91 111.272 -179.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 25.1 p -57.65 -31.23 66.09 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.344 -0.389 . . . . 12.99 111.376 -179.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.491 ' O ' ' HA2' ' A' ' 34' ' ' GLY . 13.4 t -62.84 -31.43 52.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.943 -0.571 . . . . 16.15 111.057 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -92.77 -17.54 24.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.966 0.412 . . . . 15.07 110.781 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.443 ' HA ' HG22 ' A' ' 10' ' ' THR . 5.3 m -82.11 -67.33 0.79 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.067 -0.515 . . . . 14.9 110.927 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 2.4 m -113.11 -8.79 12.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.381 -0.372 . . . . 13.84 111.51 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.491 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 85.56 -2.64 87.9 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.519 -0.848 . . . . 13.85 112.234 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -78.16 136.7 37.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.858 0.361 . . . . 18.28 110.771 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.556 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 26.0 mm-40 -77.98 149.31 76.65 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 108.708 -0.849 . . . . 15.48 108.708 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.432 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 76.4 Cg_exo -51.3 -38.19 61.63 Favored 'Trans proline' 0 CA--C 1.53 0.287 0 C-N-CA 122.555 2.17 . . . . 11.63 112.853 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.531 ' HA ' HD12 ' A' ' 41' ' ' LEU . 19.9 mp0 -71.67 -14.84 62.16 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.155 -0.475 . . . . 13.31 111.729 -179.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.556 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 31.5 mt-10 -81.18 -22.8 38.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.788 0.328 . . . . 17.34 110.295 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.506 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.9 mm? -94.68 -34.68 12.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.978 -0.555 . . . . 13.25 109.989 179.519 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.531 HD12 ' HA ' ' A' ' 38' ' ' GLN . 82.5 mt -57.88 120.89 9.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.808 -0.633 . . . . 12.99 111.068 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.15 3.3 87.52 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.66 -0.781 . . . . 13.39 112.471 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.758 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 8.7 mmpt? -112.64 163.25 14.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.86 0.362 . . . . 16.87 110.3 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.682 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 7.8 m120 -96.41 137.53 35.34 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.997 -0.547 . . . . 12.5 110.008 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 19.7 tt -63.47 -23.37 33.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.113 0.482 . . . . 11.72 111.075 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.44 HG12 ' HB3' ' A' ' 44' ' ' ASN . 8.3 p -78.73 -16.49 13.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.275 -0.42 . . . . 12.89 111.445 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.682 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.2 mt-10 -69.36 -39.83 77.86 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.019 0.437 . . . . 16.53 110.817 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.416 ' HB2' ' CZ ' ' A' ' 78' ' ' PHE . 22.8 m-85 -97.91 23.89 7.54 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.015 -0.539 . . . . 15.34 110.402 -179.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 52.4 t -104.94 147.18 28.06 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 115.847 -0.615 . . . . 11.97 110.066 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.461 ' CD2' ' HD2' ' A' ' 51' ' ' PRO . 8.4 t-160 -58.98 127.38 83.48 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.128 -0.487 . . . . 14.67 109.734 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.461 ' HD2' ' CD2' ' A' ' 50' ' ' HIS . 88.9 Cg_exo -43.6 -50.73 6.74 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.308 2.672 . . . . 15.15 113.77 -179.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.49 -3.27 17.02 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.48 0.548 . . . . 16.47 112.48 -179.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -120.58 1.83 10.64 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 122.195 -0.315 . . . . 13.16 110.901 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -62.85 -47.45 83.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.175 -0.466 . . . . 15.83 111.406 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 44.8 tp60 -69.38 -34.71 74.94 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.57 -0.53 . . . . 13.94 109.57 178.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.7 tp -57.76 -40.87 80.78 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.34 0.59 . . . . 12.11 109.81 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.407 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.7 OUTLIER -66.81 -46.06 76.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.468 -0.787 . . . . 9.71 110.02 179.052 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 69.1 ttt180 -61.45 -43.67 98.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.143 -0.481 . . . . 11.06 110.775 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -58.91 -39.13 80.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.214 0.53 . . . . 9.71 110.288 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.3 m -72.36 -33.9 67.61 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.679 -0.691 . . . . 9.52 110.618 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.523 ' O ' HG12 ' A' ' 64' ' ' VAL . 4.6 m-85 -64.29 -45.99 85.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.887 0.375 . . . . 11.4 110.207 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -64.15 -33.06 74.92 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.991 0.424 . . . . 10.04 109.928 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -64.77 -48.87 72.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.777 -0.647 . . . . 10.6 110.724 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.603 ' HA ' HD12 ' A' ' 67' ' ' LEU . 4.2 p -65.17 -26.93 40.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 CA-C-N 116.646 -0.252 . . . . 10.62 111.268 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 61' ' ' PHE . 55.5 t -69.31 -37.28 75.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 121.299 0.571 . . . . 12.41 109.694 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 27.4 mtpt -78.99 -33.0 45.42 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.794 -0.639 . . . . 16.25 109.946 179.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.727 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 66.6 mt -60.0 -56.56 20.14 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.914 -0.584 . . . . 12.66 110.639 179.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 65.3 mttt 62.21 103.65 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 O-C-N 123.861 0.726 . . . . 14.83 112.163 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 83.69 19.81 61.03 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.369 -0.919 . . . . 9.8 112.132 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.727 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 7.9 tp-100 -128.84 139.35 52.21 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.167 -0.679 . . . . 9.59 109.167 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.487 ' CG2' ' HB3' ' A' ' 91' ' ' SER . 2.6 p -97.25 117.4 41.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.129 0.49 . . . . 8.1 110.383 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 46.4 tp -106.33 117.08 33.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.907 -0.588 . . . . 7.8 110.488 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.531 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 9.1 m -93.79 106.93 18.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.054 -0.521 . . . . 7.59 110.97 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.2 p -99.67 132.02 45.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.186 -0.461 . . . . 7.84 110.19 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 23.6 ttt -102.86 119.45 38.86 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.344 -0.389 . . . . 9.35 110.344 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.501 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 46.8 p90 -150.32 -174.67 4.81 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.787 -0.642 . . . . 9.66 109.385 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.464 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 36.1 mtm180 -107.38 121.79 45.29 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.153 0.501 . . . . 13.1 110.954 179.412 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.501 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 13.0 t80 -104.12 148.46 26.24 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.352 -0.84 . . . . 9.28 109.728 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.616 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 1.1 ttt180 -88.09 123.67 33.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.9 0.381 . . . . 10.87 110.735 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.557 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 85.2 p -85.38 -176.5 6.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.018 -0.537 . . . . 10.77 109.908 179.035 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.436 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 35.4 tptt -67.97 -17.3 64.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.321 0.581 . . . . 12.66 109.755 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -88.34 2.92 51.51 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.581 -0.736 . . . . 14.42 110.247 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 67.23 19.32 10.3 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 115.596 -0.729 . . . . 12.69 110.842 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.557 ' HG2' ' OG ' ' A' ' 80' ' ' SER . 5.8 pt-20 -94.59 154.37 17.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.087 -0.506 . . . . 10.85 109.902 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.616 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 44.7 m95 -101.36 105.77 16.86 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.422 -0.354 . . . . 11.2 110.61 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.481 HD13 HD22 ' A' ' 112' ' ' ASN . 1.5 pp -107.92 151.63 25.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.23 -0.441 . . . . 11.12 110.385 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.571 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 89.8 m95 -78.43 120.88 23.79 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.073 0.463 . . . . 10.28 110.7 -179.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 5.9 tpp -122.96 140.2 53.27 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.748 -0.66 . . . . 9.32 111.071 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -102.44 94.37 5.65 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.343 -0.984 . . . . 10.66 108.343 177.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.584 HG23 ' HB3' ' A' ' 108' ' ' CYS . 45.4 m -86.92 105.21 16.93 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.893 -0.594 . . . . 9.37 112.048 -178.591 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.811 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 70.8 m -88.29 92.34 9.13 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.981 -0.554 . . . . 8.27 109.629 178.341 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' A' ' 108' ' ' CYS . 14.5 m -81.08 124.03 28.87 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.809 -0.632 . . . . 8.65 111.03 -178.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -121.57 120.16 34.02 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.815 -0.63 . . . . 11.56 109.488 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.09 115.11 10.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.875 0.369 . . . . 10.16 111.199 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -92.34 109.47 20.85 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.236 -0.438 . . . . 12.25 109.97 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.405 ' HA ' ' HA ' ' A' ' 103' ' ' ILE . 38.3 mt-30 -104.68 152.09 22.92 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.818 -0.628 . . . . 14.24 111.316 -179.26 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -91.75 137.95 25.26 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.67 -0.695 . . . . 13.83 109.425 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -73.6 36.59 0.39 Allowed 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 122.695 2.263 . . . . 15.34 113.451 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -109.77 -68.61 0.91 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.786 0.327 . . . . 16.89 110.545 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.64 20.68 8.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.335 -0.393 . . . . 14.89 110.806 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 24.2 t70 67.8 23.61 8.46 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.55 0.691 . . . . 14.77 110.406 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -82.87 142.98 31.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.055 -0.52 . . . . 12.95 111.217 -178.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.405 ' HA ' ' HA ' ' A' ' 96' ' ' GLN . 43.9 mt -87.27 113.5 24.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.191 -0.458 . . . . 11.11 110.274 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.409 ' H ' ' HG2' ' A' ' 104' ' ' GLU . 4.6 pt-20 -77.46 -41.76 38.45 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 121.069 -0.252 . . . . 11.65 110.415 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 29.4 p90 -163.82 175.15 10.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.697 0.285 . . . . 10.3 110.353 178.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 60.2 mt -118.4 121.88 68.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 116.283 -0.417 . . . . 10.29 110.449 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.493 HG12 ' HG2' ' A' ' 15' ' ' ARG . 42.1 mt -90.26 107.65 18.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.704 -0.48 . . . . 8.99 109.704 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.584 ' HB3' HG23 ' A' ' 90' ' ' THR . 72.8 m -98.96 112.7 24.74 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.186 0.517 . . . . 9.83 111.017 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.811 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 7.7 m -83.02 90.87 7.07 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.769 -0.826 . . . . 10.84 108.769 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.479 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 6.3 m-20 -79.29 94.63 5.5 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.825 -0.625 . . . . 11.26 111.67 -178.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 6.5 m -104.05 113.77 27.54 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.835 -0.431 . . . . 11.22 109.835 178.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . 0.506 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 9.4 t-20 -68.46 135.19 51.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.151 0.501 . . . . 12.78 111.097 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.416 HG12 ' HG3' ' A' ' 114' ' ' LYS . 40.7 t -109.3 -51.62 6.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.667 -0.697 . . . . 14.64 109.999 179.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.571 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 44.4 mtpt . . . . . 0 C--O 1.253 1.262 0 CA-C-O 118.276 -0.868 . . . . 16.02 109.917 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 22.0 m . . . . . 0 N--CA 1.478 0.946 0 CA-C-O 120.857 0.361 . . . . 7.49 110.074 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -138.65 163.54 46.13 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.349 -0.387 . . . . 7.12 110.77 -178.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.48 167.59 23.62 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.895 2.396 . . . . 6.18 112.023 179.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . 0.611 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.0 OUTLIER -83.17 58.49 4.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.235 0.54 . . . . 5.81 111.145 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.669 ' HA ' ' O ' ' B' ' 110' ' ' ASN . 22.6 tt0 -162.09 129.05 3.79 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.496 -0.775 . . . . 5.85 109.443 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -138.55 154.69 48.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.199 0.523 . . . . 6.08 111.661 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.649 ' HB ' ' HB2' ' B' ' 26' ' ' ASP . 10.5 mm -88.35 120.43 37.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.54 -0.755 . . . . 5.57 110.664 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.71 ' HB3' ' HE2' ' B' ' 22' ' ' PHE . 0.7 OUTLIER -108.58 93.71 4.67 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.776 -0.647 . . . . 5.3 110.374 179.723 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . 0.625 ' HD3' ' HB3' ' B' ' 24' ' ' PHE . 11.2 mtp85 -85.72 108.65 18.15 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.375 -0.602 . . . . 8.97 109.375 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . 0.483 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 30.3 p80 -141.44 166.03 25.88 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.44 -0.345 . . . . 8.31 111.14 -179.152 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 12.0 p-10 -79.36 -177.76 5.9 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.235 -0.439 . . . . 10.83 110.469 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . 0.458 HG13 ' N ' ' B' ' 19' ' ' GLU . 9.8 pt -59.1 -35.02 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 112.459 0.54 . . . . 8.89 112.459 -178.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . 0.458 ' N ' HG13 ' B' ' 18' ' ' ILE . 18.2 mt-10 -71.87 -28.3 63.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.018 0.437 . . . . 11.92 111.29 -179.371 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 117.44 -1.91 18.43 Favored Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 120.428 -0.892 . . . . 8.57 113.168 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . 0.458 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 36.9 mm -66.29 111.17 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.03 -0.359 . . . . 10.87 110.03 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . 0.71 ' HE2' ' HB3' ' B' ' 14' ' ' SER . 95.5 m-85 -66.85 130.92 44.72 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.175 -0.466 . . . . 8.23 110.941 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 1.1 m -108.6 -27.55 9.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.923 -0.581 . . . . 7.91 110.64 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . 0.625 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 15.7 t80 -160.21 137.19 9.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.014 -0.539 . . . . 7.89 109.97 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 10.9 t -125.69 146.06 32.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.429 -0.35 . . . . 6.1 110.811 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . 0.649 ' HB2' ' HB ' ' B' ' 13' ' ' ILE . 5.8 t0 -71.16 161.89 30.35 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.463 -0.569 . . . . 7.15 109.463 179.036 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 17.1 m170 -80.26 37.03 0.37 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.811 0.339 . . . . 8.97 111.251 -179.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . 0.508 ' HD2' ' O ' ' B' ' 11' ' ' GLU . 29.0 mtm180 -128.39 3.07 5.66 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.887 0.375 . . . . 9.76 111.114 -179.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 1.8 p -62.74 -46.77 86.51 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 112.413 0.523 . . . . 11.56 112.413 -178.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 6.7 t -67.54 -26.48 35.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 121.079 0.466 . . . . 13.64 111.038 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.87 -22.13 43.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.217 -0.447 . . . . 12.9 111.108 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 13.0 m -92.57 -59.7 2.01 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.29 0.478 . . . . 12.13 112.29 -178.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' VAL . . . . . 0.561 HG12 HD21 ' B' ' 86' ' ' LEU . 3.2 m -118.63 -5.53 11.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 112.195 0.442 . . . . 13.87 112.195 -178.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.3 20.34 64.76 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.536 -0.84 . . . . 13.79 112.21 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' TYR . . . . . 0.455 ' HD1' ' HA ' ' B' ' 35' ' ' TYR . 1.0 OUTLIER -93.0 130.72 38.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.675 0.274 . . . . 15.38 110.909 -179.726 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -75.0 144.86 80.13 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 109.111 -0.7 . . . . 13.78 109.111 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.442 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 52.2 Cg_exo -54.52 -32.99 76.42 Favored 'Trans proline' 0 CA--C 1.529 0.233 0 C-N-CA 122.459 2.106 . . . . 14.71 112.23 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' GLN . . . . . 0.566 ' HA ' HD12 ' B' ' 41' ' ' LEU . 26.9 mp0 -75.52 -17.11 60.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.615 -0.721 . . . . 17.54 111.971 -179.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -75.54 -40.26 57.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.96 0.409 . . . . 14.24 110.574 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.524 ' HB3' ' CG ' ' B' ' 22' ' ' PHE . 1.9 mm? -74.84 -26.02 59.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.836 -0.62 . . . . 14.03 111.201 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.566 HD12 ' HA ' ' B' ' 38' ' ' GLN . 75.3 mt -61.48 119.8 9.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 13.62 111.469 -179.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.6 11.72 79.32 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.834 -0.698 . . . . 11.62 113.055 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.591 ' HE2' ' HA ' ' B' ' 43' ' ' LYS . 8.6 mmpt? -121.88 158.58 28.67 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.754 0.311 . . . . 13.82 110.479 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' ASN . . . . . 0.56 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 12.4 m120 -94.16 139.94 30.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.055 -0.52 . . . . 10.16 109.84 179.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.6 tt -62.08 -24.48 34.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.996 0.427 . . . . 9.62 111.378 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 6.3 p -71.88 -18.29 19.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.172 -0.467 . . . . 11.5 111.217 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . 0.56 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 38.1 mt-10 -75.81 -23.15 55.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.995 0.426 . . . . 11.89 111.031 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -110.09 22.05 16.05 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.023 -0.535 . . . . 13.6 110.092 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 51.4 t -110.6 150.87 28.34 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.682 -0.69 . . . . 10.81 110.451 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -59.64 126.24 82.19 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.807 -0.633 . . . . 11.49 109.576 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' PRO . . . . . 0.407 ' HA ' ' OE1' ' B' ' 54' ' ' GLN . 81.9 Cg_exo -47.29 -42.21 27.55 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.058 2.505 . . . . 11.35 113.58 -179.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 9.1 mp0 -78.45 0.32 26.31 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 112.334 0.494 . . . . 9.28 112.334 -179.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -129.83 5.05 5.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.888 0.375 . . . . 7.52 110.933 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . 0.407 ' OE1' ' HA ' ' B' ' 51' ' ' PRO . 70.8 mt-30 -63.75 -43.46 96.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.104 -0.498 . . . . 6.57 110.719 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 49.6 tp60 -63.63 -39.63 94.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.956 -0.566 . . . . 6.58 109.535 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.78 -42.42 84.08 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.986 -0.552 . . . . 4.6 110.498 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.439 HD23 ' HA ' ' B' ' 57' ' ' LEU . 0.5 OUTLIER -63.72 -51.76 63.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 6.4 110.269 179.489 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . 0.404 ' O ' ' HG2' ' B' ' 62' ' ' GLN . 70.8 ttt180 -58.79 -44.29 90.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.82 -0.627 . . . . 8.18 110.878 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -59.25 -42.87 92.13 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.749 -0.66 . . . . 6.07 110.975 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 20.3 m -66.82 -34.02 76.9 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.867 -0.606 . . . . 5.59 110.592 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 61' ' ' PHE . . . . . 0.408 ' O ' HG12 ' B' ' 64' ' ' VAL . 9.5 m-85 -64.64 -37.87 89.05 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.104 0.478 . . . . 7.73 109.781 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' B' ' 58' ' ' ARG . 21.1 mm100 -63.99 -44.45 92.62 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.805 -0.634 . . . . 6.89 110.524 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -68.08 -40.44 82.68 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.615 -0.721 . . . . 9.4 111.776 -179.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.412 HG21 ' O ' ' B' ' 92' ' ' SER . 9.5 p -68.17 -28.57 41.39 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 C-N-CA 120.861 -0.336 . . . . 7.57 110.512 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . 0.411 ' HA ' HG21 ' B' ' 94' ' ' THR . 20.3 t -71.46 -37.25 63.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.01 -0.737 . . . . 7.43 109.01 178.113 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 18.3 mtpt -68.82 -37.52 79.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.527 -0.761 . . . . 10.21 110.278 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 48.2 mt -62.02 -49.45 75.99 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.909 -0.587 . . . . 7.2 110.292 179.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 22.1 mttt 63.85 112.23 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 O-C-N 124.006 0.816 . . . . 7.58 112.46 179.133 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 77.18 23.07 69.46 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.851 -0.69 . . . . 5.57 112.72 178.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -129.8 166.16 20.48 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.818 0.342 . . . . 5.43 110.697 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 71' ' ' VAL . . . . . 0.642 ' HB ' ' HD1' ' B' ' 93' ' ' PHE . 2.8 p -116.19 120.34 64.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.874 -0.603 . . . . 5.65 110.874 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 46.3 tp -107.22 119.5 39.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.914 -0.584 . . . . 4.51 109.96 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . 0.413 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 0.9 OUTLIER -89.38 111.73 22.66 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.97 -0.559 . . . . 6.35 110.781 -179.48 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.4 p -110.84 132.39 59.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.859 -0.423 . . . . 4.34 109.859 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 21.7 ttt -106.45 114.96 29.39 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.095 0.474 . . . . 5.42 110.972 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.546 ' HE2' ' HD1' ' B' ' 78' ' ' PHE . 49.6 p90 -144.96 -175.35 4.65 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.505 -0.771 . . . . 3.54 108.998 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 77' ' ' ARG . . . . . 0.464 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 40.4 mtm180 -106.7 118.47 36.75 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.048 0.451 . . . . 6.8 110.497 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.546 ' HD1' ' HE2' ' B' ' 76' ' ' PHE . 14.8 t80 -97.13 145.66 25.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.297 -0.865 . . . . 5.79 110.201 -179.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 79' ' ' ARG . . . . . 0.532 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 22.4 ttp180 -85.8 129.72 34.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.3 -0.409 . . . . 11.08 110.676 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . 0.547 ' HA ' ' HB ' ' B' ' 33' ' ' VAL . 88.6 p -89.77 -177.83 5.35 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.704 -0.48 . . . . 7.47 109.704 178.628 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 51.6 tptt -68.47 -23.38 64.58 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.325 0.583 . . . . 12.24 109.547 178.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -86.13 4.66 37.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.631 -0.713 . . . . 9.25 110.349 178.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 67.07 29.23 8.04 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.45 -0.796 . . . . 8.3 111.469 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . 0.457 ' O ' ' HA ' ' B' ' 79' ' ' ARG . 1.7 pt-20 -95.88 152.91 18.07 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.153 -0.684 . . . . 6.78 109.153 178.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . 0.532 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 73.2 m95 -104.31 93.89 5.06 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.792 0.33 . . . . 7.89 110.384 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.561 HD21 HG12 ' B' ' 33' ' ' VAL . 1.8 pp -96.99 148.8 22.6 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.224 -0.444 . . . . 6.97 110.494 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 87' ' ' TRP . . . . . 0.497 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 90.5 m95 -72.82 121.99 20.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.965 0.412 . . . . 8.55 110.581 -179.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 27.2 tpp -122.47 131.62 53.95 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.782 -0.645 . . . . 4.46 110.981 -178.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 15.9 ttp180 -100.38 72.69 1.62 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.517 -0.92 . . . . 6.87 108.517 178.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 90' ' ' THR . . . . . 0.51 HG23 ' HB3' ' B' ' 108' ' ' CYS . 54.0 m -66.81 113.02 4.56 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.201 -0.908 . . . . 6.18 112.083 -178.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 91' ' ' SER . . . . . 0.413 ' HA ' ' HA ' ' B' ' 73' ' ' SER . 1.6 m -95.1 96.82 9.49 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.935 -0.765 . . . . 6.3 108.935 178.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 92' ' ' SER . . . . . 0.467 ' O ' ' HA ' ' B' ' 71' ' ' VAL . 16.3 m -84.06 117.39 23.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.274 -0.421 . . . . 6.65 111.819 -178.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . 0.642 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 71.2 t80 -110.08 122.12 46.84 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.086 -0.506 . . . . 6.45 110.161 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . 0.411 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.7 OUTLIER -87.3 118.4 26.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.755 0.312 . . . . 9.17 111.01 179.796 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 95' ' ' PHE . . . . . 0.459 ' O ' ' HA ' ' B' ' 103' ' ' ILE . 0.0 OUTLIER -83.58 130.9 35.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.811 0.339 . . . . 8.33 110.919 -179.837 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -104.71 111.04 23.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.964 -0.562 . . . . 10.53 110.958 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 97' ' ' ASN . . . . . 0.478 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 65.3 t30 -74.32 127.3 87.93 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 109.513 -0.551 . . . . 8.43 109.513 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 98' ' ' PRO . . . . . 0.478 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 62.1 Cg_endo -74.71 20.02 0.45 Allowed 'Trans proline' 0 CA--C 1.535 0.554 0 C-N-CA 122.714 2.276 . . . . 9.16 113.884 -179.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -91.69 -56.72 3.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.938 0.399 . . . . 11.34 110.1 179.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 100' ' ' SER . . . . . 0.427 ' HB2' ' HG3' ' B' ' 102' ' ' GLU . 1.4 m -135.95 16.46 3.28 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.531 -0.544 . . . . 7.75 109.531 179.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 23.7 t70 63.84 40.26 7.68 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.232 -0.894 . . . . 9.08 110.497 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . 0.427 ' HG3' ' HB2' ' B' ' 100' ' ' SER . 0.0 OUTLIER -96.83 158.87 15.22 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.708 -0.678 . . . . 7.71 110.481 179.948 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 103' ' ' ILE . . . . . 0.459 ' HA ' ' O ' ' B' ' 95' ' ' PHE . 68.7 mt -95.44 105.05 16.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.709 -0.478 . . . . 8.04 109.709 179.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -60.59 -52.33 65.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.84 -0.618 . . . . 8.81 110.962 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -164.37 171.16 15.13 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.613 -0.721 . . . . 7.4 110.019 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 37.8 mt -108.47 119.54 58.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.952 -0.567 . . . . 6.78 109.951 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.408 ' HB ' ' HB3' ' B' ' 93' ' ' PHE . 33.5 mt -86.6 97.98 6.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 109.443 -0.577 . . . . 6.31 109.443 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 108' ' ' CYS . . . . . 0.51 ' HB3' HG23 ' B' ' 90' ' ' THR . 92.5 m -92.68 104.38 16.66 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.178 0.436 . . . . 5.31 112.178 -179.103 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . 0.414 ' HA ' HD13 ' B' ' 13' ' ' ILE . 3.5 m -78.28 97.46 5.57 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.606 -0.887 . . . . 5.48 108.606 177.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 110' ' ' ASN . . . . . 0.669 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.2 m-20 -80.56 89.02 5.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.012 -0.54 . . . . 6.9 111.78 -178.118 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 3.3 m -94.78 112.55 24.28 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.199 -0.455 . . . . 8.61 110.496 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 112' ' ' ASN . . . . . 0.611 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 4.2 t-20 -70.49 131.66 44.37 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.068 0.461 . . . . 11.84 110.779 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 93.5 t -104.79 -55.94 5.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.591 -0.732 . . . . 11.77 109.986 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . 0.497 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 42.2 mtpt . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.197 -0.906 . . . . 12.68 109.937 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 . . . . . 0 C--O 1.232 0.15 0 N-CA-C 110.239 -0.282 . . . . 15.08 110.239 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.408 ' HG2' ' HD2' ' A' ' 28' ' ' ARG . 33.0 Cg_endo -65.75 154.32 74.38 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.572 2.181 . . . . 13.43 111.94 179.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.715 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.8 OUTLIER -77.35 43.25 0.37 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.229 0.538 . . . . 11.09 111.33 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.571 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 32.8 tt0 -145.75 126.48 14.33 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.852 -0.796 . . . . 10.59 108.852 -179.306 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.957 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 33.5 p90 -145.35 156.42 43.78 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.088 0.47 . . . . 8.93 111.342 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.567 HG23 HG23 ' A' ' 107' ' ' ILE . 21.8 mm -85.31 117.13 29.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.681 -0.69 . . . . 8.66 110.995 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.434 ' HB3' ' HE1' ' A' ' 22' ' ' PHE . 0.8 OUTLIER -105.75 92.5 4.2 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.119 -0.492 . . . . 6.11 110.294 179.481 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 15' ' ' ARG . 6.4 mtt180 -81.48 117.59 22.03 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.482 -0.562 . . . . 9.09 109.482 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.1 p80 -149.16 159.28 44.38 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.921 -0.311 . . . . 9.79 111.041 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.2 p-10 -80.76 178.06 8.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.308 -0.406 . . . . 12.69 110.349 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.9 pt -58.56 -28.07 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 113.087 0.773 . . . . 13.58 113.087 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -75.06 -23.65 58.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.28 0.562 . . . . 13.85 110.878 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 112.84 -7.27 25.74 Favored Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 120.841 -0.695 . . . . 9.38 111.748 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.461 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 38.9 mm -66.88 115.19 4.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 110.011 -0.366 . . . . 10.74 110.011 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.461 ' CZ ' ' HB ' ' A' ' 45' ' ' ILE . 98.0 m-85 -71.37 128.59 36.38 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.953 -0.567 . . . . 9.73 111.402 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 23.4 p -95.04 -31.59 13.52 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.25 -0.886 . . . . 7.74 110.102 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -155.47 132.16 10.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.465 -0.789 . . . . 6.92 109.423 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.656 HG21 ' HB2' ' A' ' 40' ' ' LEU . 21.6 t -116.99 143.38 27.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.722 0.296 . . . . 6.02 110.972 -179.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.957 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 6.9 t70 -67.23 166.03 14.98 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.76 -0.654 . . . . 7.31 110.396 179.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 51.5 m170 -87.82 -13.28 42.58 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.928 0.395 . . . . 11.67 110.648 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.488 HH22 HG21 ' B' ' 107' ' ' ILE . 79.2 mtm180 -81.73 -1.96 48.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.227 -0.442 . . . . 11.91 112.033 -179.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 29.2 p -65.04 -30.45 71.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.945 0.402 . . . . 12.99 111.257 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.465 HG13 HE22 ' A' ' 36' ' ' GLN . 24.7 t -61.47 -39.72 83.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.838 -0.619 . . . . 16.15 111.665 -179.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.73 -18.19 33.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.703 0.287 . . . . 15.07 111.426 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.3 m -85.09 -53.3 5.36 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.344 -0.389 . . . . 14.9 111.917 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.48 HG23 ' H ' ' A' ' 35' ' ' TYR . 3.7 m -123.5 -15.5 5.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.2 0.445 . . . . 13.84 112.2 -179.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 92.41 -13.82 66.28 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.439 -0.886 . . . . 13.85 111.833 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.48 ' H ' HG23 ' A' ' 33' ' ' VAL . 4.7 m-30 -71.46 133.04 45.6 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.679 -0.26 . . . . 18.28 110.58 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.497 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 37.3 mm-40 -78.25 150.77 77.65 Favored Pre-proline 0 C--N 1.321 -0.668 0 N-CA-C 108.445 -0.946 . . . . 15.48 108.445 178.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.616 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 74.5 Cg_exo -50.22 -43.17 44.43 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.468 2.112 . . . . 11.63 112.515 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -63.49 -22.51 66.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.001 -0.545 . . . . 13.31 112.099 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.497 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 36.5 mt-10 -74.9 -22.54 58.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.852 0.358 . . . . 17.34 110.922 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.656 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.9 mm? -98.14 -30.07 12.86 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.124 -0.489 . . . . 13.25 110.792 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 92.3 mt -62.77 108.28 1.14 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 12.99 111.217 -179.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 97.04 2.86 59.21 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.894 -0.67 . . . . 13.39 112.153 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.785 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 4.1 mmpt? -112.4 158.26 20.04 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 110.331 -0.248 . . . . 16.87 110.331 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.818 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 15.4 m120 -94.01 135.86 34.91 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.973 -0.38 . . . . 12.5 109.973 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.461 ' HB ' ' CZ ' ' A' ' 22' ' ' PHE . 13.8 tt -63.79 -27.34 42.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.014 0.435 . . . . 11.72 110.501 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 6.1 p -68.5 -17.72 22.47 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 116.086 -0.507 . . . . 12.89 111.392 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.818 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 34.9 mt-10 -78.49 -35.04 47.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.939 0.4 . . . . 16.53 111.143 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.459 ' HE2' ' HB3' ' A' ' 43' ' ' LYS . 48.8 m-85 -95.46 6.44 48.97 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.183 0.516 . . . . 15.34 110.752 -179.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 48.9 t -93.75 154.66 17.65 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.807 -0.633 . . . . 11.97 110.343 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.527 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 3.7 t-160 -62.43 128.44 91.37 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.647 -0.706 . . . . 14.67 109.512 179.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -44.6 -50.47 8.18 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 123.195 2.597 . . . . 15.15 114.25 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -73.1 -11.56 60.59 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.794 0.294 . . . . 16.47 111.794 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.527 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 5.5 m-20 -107.29 -0.16 22.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.863 0.363 . . . . 13.16 110.881 -179.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -60.89 -50.21 74.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.046 -0.524 . . . . 15.83 111.17 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -64.38 -36.05 82.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.786 0.327 . . . . 13.94 110.24 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 29.7 tp -58.1 -45.41 87.27 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.2 0.524 . . . . 12.11 109.744 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.429 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.4 OUTLIER -68.12 -47.23 68.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.481 -0.781 . . . . 9.71 109.984 179.041 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 36.9 ttt180 -54.26 -47.22 72.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.213 -0.903 . . . . 11.06 111.279 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -64.61 -43.86 92.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.133 -0.485 . . . . 9.71 110.924 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.7 m -60.04 -35.28 74.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.342 -0.39 . . . . 9.52 110.645 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.543 ' O ' HG12 ' A' ' 64' ' ' VAL . 7.4 m-85 -65.28 -46.09 81.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.321 -0.4 . . . . 11.4 110.19 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -66.27 -34.97 79.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.195 0.522 . . . . 10.04 109.944 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -63.87 -40.67 97.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.667 -0.697 . . . . 10.6 110.61 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.543 HG12 ' O ' ' A' ' 61' ' ' PHE . 0.4 OUTLIER -70.02 -25.63 28.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 116.564 -0.289 . . . . 10.62 110.872 -179.731 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 61' ' ' PHE . 75.5 t -69.03 -37.79 77.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 109.026 -0.731 . . . . 12.41 109.026 178.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 48.5 mtpt -76.5 -28.52 56.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.252 -0.886 . . . . 16.25 110.242 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.641 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 58.3 mt -71.71 -56.74 5.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.466 . . . . 12.66 110.79 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.417 ' HG3' ' O ' ' A' ' 65' ' ' VAL . 78.7 mttt 62.47 104.96 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 O-C-N 123.727 0.642 . . . . 14.83 112.315 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.04 -4.03 86.58 Favored Glycine 0 N--CA 1.454 -0.16 0 C-N-CA 120.716 -0.754 . . . . 9.8 112.942 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.641 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 7.1 tp-100 -101.53 130.31 47.78 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.67 -0.493 . . . . 9.59 109.67 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 2.7 p -83.29 107.26 14.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.288 0.566 . . . . 8.1 110.251 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 20.1 tp -100.08 110.98 23.28 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.996 -0.547 . . . . 7.8 110.312 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.441 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 0.0 OUTLIER -89.23 108.6 19.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.998 -0.546 . . . . 7.59 111.096 -179.612 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.428 HG13 ' HB ' ' A' ' 90' ' ' THR . 2.3 p -100.36 125.35 54.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.13 -0.486 . . . . 7.84 109.758 178.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 23.0 ttt -100.52 106.87 18.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.341 -0.391 . . . . 9.35 110.349 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.503 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 46.0 p90 -134.25 -174.47 3.56 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.815 -0.63 . . . . 9.66 110.159 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.491 ' HB2' ' HB2' ' A' ' 50' ' ' HIS . 47.4 mtt180 -105.08 117.14 33.25 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.184 -0.462 . . . . 13.1 110.195 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.503 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 11.4 t80 -107.03 147.6 29.74 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.019 -0.537 . . . . 9.28 109.888 -179.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.535 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 35.2 ttp180 -87.9 136.47 32.95 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.852 0.358 . . . . 10.87 110.885 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.417 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 66.0 p -96.52 -174.39 3.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.103 -0.499 . . . . 10.77 109.999 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.446 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 42.1 tptt -70.65 -14.25 62.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.346 0.593 . . . . 12.66 109.841 178.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -92.6 3.1 56.2 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.782 -0.644 . . . . 14.42 109.624 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 67.4 20.7 9.88 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.4 -0.818 . . . . 12.69 111.172 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.417 ' HG2' ' OG ' ' A' ' 80' ' ' SER . 3.2 pt-20 -96.07 153.47 17.76 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.357 -0.608 . . . . 10.85 109.357 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.535 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 67.1 m95 -100.29 112.17 24.49 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.892 0.377 . . . . 11.2 110.676 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.446 HD13 HD22 ' A' ' 112' ' ' ASN . 1.5 pp -110.02 156.04 21.04 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.241 -0.436 . . . . 11.12 110.643 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.513 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 82.5 m95 -81.67 114.65 20.48 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.197 0.523 . . . . 10.28 110.786 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 38.1 tpp -114.92 131.54 56.84 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.435 -0.802 . . . . 9.32 110.886 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.6 ttp180 -101.52 76.84 1.71 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.838 -0.801 . . . . 10.66 108.838 178.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.72 HG23 ' HB3' ' A' ' 108' ' ' CYS . 36.7 m -67.33 109.58 3.2 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.381 -0.827 . . . . 9.37 112.066 -178.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.441 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 0.7 OUTLIER -90.25 88.8 7.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.265 -0.879 . . . . 8.27 109.442 179.506 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.1 m -74.07 131.27 41.17 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.95 -0.568 . . . . 8.65 111.897 -178.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -130.3 122.43 27.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.878 -0.601 . . . . 11.56 110.176 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.26 119.24 18.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.402 -0.363 . . . . 10.16 111.388 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -101.52 106.97 18.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.942 0.401 . . . . 12.25 109.997 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -104.01 152.02 22.53 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.086 -0.506 . . . . 14.24 111.335 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.439 ' HB3' ' OE1' ' A' ' 102' ' ' GLU . 11.4 t-20 -86.3 133.03 41.4 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 108.79 -0.818 . . . . 13.83 108.79 178.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.62 14.4 0.41 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 122.81 2.34 . . . . 15.34 113.898 -178.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -87.29 -54.72 4.15 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.883 0.373 . . . . 16.89 110.294 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 18.8 m -142.38 19.91 2.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.142 -0.481 . . . . 14.89 110.179 178.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 18.4 t70 67.93 32.15 5.28 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.703 -0.681 . . . . 14.77 110.561 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . 0.439 ' OE1' ' HB3' ' A' ' 97' ' ' ASN . 1.6 mp0 -76.5 122.6 24.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.014 -0.539 . . . . 12.95 110.089 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 50.9 mt -70.57 108.56 2.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 109.993 -0.373 . . . . 11.11 109.993 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -72.78 -54.32 9.21 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.057 -0.52 . . . . 11.65 110.281 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -162.4 179.67 7.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.667 -0.697 . . . . 10.3 110.066 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 56.5 mt -115.64 117.89 57.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.222 -0.445 . . . . 10.29 110.468 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.604 HG21 HH22 ' B' ' 15' ' ' ARG . 33.4 mt -89.5 102.91 13.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.51 -0.552 . . . . 8.99 109.51 179.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.72 ' HB3' HG23 ' A' ' 90' ' ' THR . 99.5 m -97.15 112.69 24.36 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.227 0.537 . . . . 9.83 111.828 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.482 HG21 HG21 ' B' ' 13' ' ' ILE . 1.6 m -80.66 98.14 7.56 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 108.652 -0.87 . . . . 10.84 108.652 178.211 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.571 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 4.5 m-20 -80.55 99.84 8.29 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.148 -0.478 . . . . 11.26 111.544 -178.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.439 HG23 ' HB2' ' A' ' 11' ' ' GLU . 3.1 m -106.22 109.74 21.77 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.863 -0.608 . . . . 11.22 109.976 178.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . 0.715 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 5.0 t-20 -75.19 134.88 41.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.881 0.372 . . . . 12.78 110.719 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.581 HG12 ' HG3' ' A' ' 114' ' ' LYS . 76.8 t -111.34 -50.55 6.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.91 -0.586 . . . . 14.64 109.9 179.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.581 ' HG3' HG12 ' A' ' 113' ' ' VAL . 61.3 mtpt . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.142 -0.932 . . . . 16.02 110.024 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 41.9 m . . . . . 0 N--CA 1.479 0.996 0 CA-C-O 121.05 0.453 . . . . 7.49 109.922 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' GLN . . . . . 0.468 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 26.4 mm-40 -124.88 135.94 27.38 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.287 -0.415 . . . . 7.12 110.604 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' PRO . . . . . 0.466 ' HD2' ' HG2' ' B' ' 28' ' ' ARG . 37.6 Cg_exo -61.06 154.8 54.49 Favored 'Trans proline' 0 CA--C 1.53 0.306 0 C-N-CA 122.763 2.308 . . . . 6.18 112.309 179.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.33 46.57 1.05 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.494 0.664 . . . . 5.81 110.654 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.635 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 62.3 tt0 -155.68 115.52 3.67 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.168 -0.923 . . . . 5.85 108.584 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' PHE . . . . . 0.654 ' HB3' ' HB2' ' B' ' 28' ' ' ARG . 33.9 p90 -137.23 155.99 48.84 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.505 0.557 . . . . 6.08 112.505 -178.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.495 HG13 HG23 ' B' ' 107' ' ' ILE . 3.4 tt -84.8 118.94 32.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.42 -0.809 . . . . 5.57 110.741 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.76 100.87 10.41 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.042 -0.527 . . . . 5.3 110.008 179.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . 0.604 HH22 HG21 ' A' ' 107' ' ' ILE . 9.4 mtp180 -88.88 105.1 17.52 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.882 -0.414 . . . . 8.97 109.882 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 34.5 p80 -131.71 155.94 46.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.952 -0.567 . . . . 8.31 110.217 -179.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -74.58 173.42 10.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.62 -0.264 . . . . 10.83 110.406 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.5 pt -56.78 -31.15 34.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 N-CA-C 112.846 0.684 . . . . 8.89 112.846 -178.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -71.15 -27.52 63.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.021 0.439 . . . . 11.92 111.254 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 117.82 -2.97 17.35 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.565 -0.826 . . . . 8.57 112.664 179.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . 0.406 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 19.3 mm -75.31 123.51 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 110.152 -0.314 . . . . 10.87 110.152 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . 0.542 ' CZ ' ' HB ' ' B' ' 45' ' ' ILE . 97.2 m-85 -74.74 130.65 39.87 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.877 0.37 . . . . 8.23 111.254 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 19.4 m -102.38 -39.95 6.94 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.982 -0.554 . . . . 7.91 110.309 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . 0.439 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 44.0 t80 -152.12 134.03 14.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.945 -0.57 . . . . 7.89 109.897 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 2.0 m -131.56 156.66 42.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.539 -0.301 . . . . 6.1 110.589 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . 0.555 ' HB3' ' HB2' ' B' ' 12' ' ' PHE . 11.8 t70 -81.95 158.98 23.7 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.04 -0.527 . . . . 7.15 110.466 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -67.92 -17.7 64.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.306 -0.406 . . . . 8.97 111.475 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . 0.654 ' HB2' ' HB3' ' B' ' 12' ' ' PHE . 65.5 mtm180 -62.98 -16.82 60.96 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.255 -0.429 . . . . 9.76 111.858 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 29.3 p -60.21 -36.3 77.36 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.749 0.309 . . . . 11.56 111.654 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.477 ' O ' ' HA2' ' B' ' 34' ' ' GLY . 47.3 t -63.25 -31.42 52.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.972 -0.558 . . . . 13.64 111.34 -179.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -91.16 -21.09 21.34 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.809 0.338 . . . . 12.9 111.308 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 26.0 m -82.92 -57.05 3.46 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.066 0.395 . . . . 12.13 112.066 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' VAL . . . . . 0.553 HG11 ' HD2' ' B' ' 78' ' ' PHE . 0.2 OUTLIER -117.31 -11.68 11.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 111.83 0.307 . . . . 13.87 111.83 -179.391 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' GLY . . . . . 0.477 ' HA2' ' O ' ' B' ' 30' ' ' VAL . . . 90.01 -0.82 79.57 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.506 -0.854 . . . . 13.79 112.364 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 -79.57 132.51 36.31 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.654 0.264 . . . . 15.38 111.033 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . 0.456 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 80.8 mm-40 -76.6 147.12 77.96 Favored Pre-proline 0 C--N 1.321 -0.674 0 N-CA-C 107.993 -1.114 . . . . 13.78 107.993 177.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.632 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 72.5 Cg_exo -49.86 -39.93 48.66 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.561 2.174 . . . . 14.71 112.878 -179.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -66.93 -17.03 64.72 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.914 -0.584 . . . . 17.54 112.531 -179.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.456 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 33.2 mt-10 -78.74 -32.21 46.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.885 0.374 . . . . 14.24 110.648 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' B' ' 22' ' ' PHE . 1.8 mm? -82.88 -30.7 28.34 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.067 -0.515 . . . . 14.03 110.985 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.632 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 58.8 mt -61.7 104.8 0.47 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.253 -0.43 . . . . 13.62 111.668 -179.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 100.69 5.81 53.38 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.85 -0.69 . . . . 11.62 112.85 179.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.666 ' HE2' ' HA ' ' B' ' 43' ' ' LYS . 6.1 mmpt? -118.85 157.31 27.86 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.612 0.244 . . . . 13.82 110.68 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' ASN . . . . . 0.791 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 18.8 m120 -93.4 137.1 33.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.235 -0.438 . . . . 10.16 110.177 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . 0.542 ' HB ' ' CZ ' ' B' ' 22' ' ' PHE . 14.1 tt -59.69 -29.42 42.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.143 0.497 . . . . 9.62 110.952 179.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' VAL . . . . . 0.422 HG12 ' HB3' ' B' ' 44' ' ' ASN . 7.9 p -69.63 -20.91 24.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.991 -0.549 . . . . 11.5 111.401 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . 0.791 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 38.6 mt-10 -74.15 -20.78 60.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.926 0.393 . . . . 11.89 110.935 -179.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' PHE . . . . . 0.407 ' HB2' ' CZ ' ' B' ' 78' ' ' PHE . 40.6 m-85 -112.04 18.87 18.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.101 0.477 . . . . 13.6 109.906 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 51.9 t -102.88 151.62 22.23 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.818 -0.628 . . . . 10.81 110.636 -179.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' HIS . . . . . 0.611 ' HB3' ' HB2' ' B' ' 53' ' ' ASP . 5.0 t-80 -57.36 130.22 80.56 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.835 -0.62 . . . . 11.49 109.472 178.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -46.49 -45.77 18.66 Favored 'Trans proline' 0 CA--C 1.534 0.481 0 C-N-CA 123.048 2.499 . . . . 11.35 113.587 -179.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -82.34 6.55 16.66 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.138 0.421 . . . . 9.28 112.138 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . 0.611 ' HB2' ' HB3' ' B' ' 50' ' ' HIS . 5.2 m-20 -125.1 -0.7 7.78 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.033 0.444 . . . . 7.52 110.498 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -64.4 -46.88 81.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.835 -0.62 . . . . 6.57 111.102 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 49.2 tp60 -61.51 -42.16 98.38 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.108 -0.497 . . . . 6.58 110.402 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 65.4 tp -59.44 -42.09 91.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.081 -0.509 . . . . 4.6 110.28 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.41 HD22 ' CZ ' ' B' ' 61' ' ' PHE . 0.5 OUTLIER -62.87 -49.95 72.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.089 -0.505 . . . . 6.4 110.043 179.356 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -58.18 -46.04 86.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.435 -0.802 . . . . 8.18 111.239 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -62.7 -38.69 91.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.095 -0.502 . . . . 6.07 111.197 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 31.0 m -68.74 -36.79 78.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.149 -0.478 . . . . 5.59 110.982 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 61' ' ' PHE . . . . . 0.593 ' O ' HG12 ' B' ' 64' ' ' VAL . 8.2 m-85 -62.51 -46.46 88.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.759 0.314 . . . . 7.73 110.738 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -67.04 -27.69 67.6 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.933 0.397 . . . . 6.89 110.555 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.543 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 18.2 mt-30 -72.53 -42.06 65.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.048 -0.524 . . . . 9.4 110.933 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.593 HG12 ' O ' ' B' ' 61' ' ' PHE . 3.2 p -66.04 -25.13 35.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.802 0.334 . . . . 7.57 110.31 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . 0.5 HG23 ' O ' ' B' ' 61' ' ' PHE . 89.3 t -72.22 -32.56 43.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 109.264 -0.643 . . . . 7.43 109.264 178.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -71.84 -34.72 69.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.65 -0.704 . . . . 10.21 110.182 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' B' ' 63' ' ' GLN . 24.3 mt -68.94 -51.18 42.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.772 -0.649 . . . . 7.2 109.975 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 31.1 mttt 59.44 102.31 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 O-C-N 124.12 0.887 . . . . 7.58 112.383 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.63 16.61 54.62 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.649 -0.786 . . . . 5.57 112.328 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -126.45 162.16 26.25 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 110.275 -0.269 . . . . 5.43 110.275 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 71' ' ' VAL . . . . . 0.4 ' HA ' ' O ' ' B' ' 92' ' ' SER . 24.8 t -106.88 121.09 59.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.342 -0.39 . . . . 5.65 111.125 -179.017 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 21.2 tp -115.81 104.09 11.3 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.216 -0.661 . . . . 4.51 109.216 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . 0.476 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.4 m -86.21 117.97 25.37 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.908 -0.587 . . . . 6.35 111.032 -179.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.7 p -103.86 129.05 56.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.024 -0.534 . . . . 4.34 110.21 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 10.7 tpt -100.47 117.1 33.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.124 -0.489 . . . . 5.42 110.362 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -154.31 -171.91 4.03 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.393 -0.367 . . . . 3.54 110.205 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 77' ' ' ARG . . . . . 0.597 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 11.8 mtm180 -108.59 119.33 39.19 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.961 0.41 . . . . 6.8 110.62 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.553 ' HD2' HG11 ' B' ' 33' ' ' VAL . 19.5 t80 -102.38 144.78 30.43 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.482 -0.781 . . . . 5.79 110.03 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 79' ' ' ARG . . . . . 0.562 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 35.7 ttp180 -80.34 136.54 36.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.725 0.298 . . . . 11.08 110.517 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . 0.556 ' OG ' ' HG2' ' B' ' 84' ' ' GLU . 88.9 p -99.26 -176.34 3.27 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.866 -0.42 . . . . 7.47 109.866 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . 0.425 ' HA ' ' HD2' ' B' ' 81' ' ' LYS . 32.2 tptt -70.19 -10.42 58.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.566 0.698 . . . . 12.24 109.688 178.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 33.2 m-20 -96.39 3.49 52.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.416 -0.811 . . . . 9.25 109.796 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 67.49 17.5 10.04 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.511 -0.768 . . . . 8.3 111.327 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . 0.556 ' HG2' ' OG ' ' B' ' 80' ' ' SER . 7.1 pt-20 -94.91 158.94 15.26 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.236 -0.653 . . . . 6.78 109.236 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . 0.597 ' HB3' ' HB3' ' B' ' 77' ' ' ARG . 42.2 m95 -106.48 108.65 20.27 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 121.03 -0.268 . . . . 7.89 110.631 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' B' ' 77' ' ' ARG . 1.9 pp -105.57 152.68 22.77 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.345 -0.388 . . . . 6.97 110.129 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 87' ' ' TRP . . . . . 0.79 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 95.1 m95 -80.88 120.32 24.56 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.034 0.445 . . . . 8.55 110.835 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 2.0 ttp -132.0 140.48 48.95 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.929 -0.578 . . . . 4.46 110.889 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 28.5 ttp180 -103.01 93.89 5.26 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.776 -0.647 . . . . 6.87 109.36 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 90' ' ' THR . . . . . 0.545 ' CG2' ' HB3' ' B' ' 108' ' ' CYS . 6.4 m -78.47 105.37 9.69 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.014 -0.539 . . . . 6.18 111.281 -179.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 91' ' ' SER . . . . . 0.476 ' HA ' ' HA ' ' B' ' 73' ' ' SER . 0.9 OUTLIER -84.05 94.86 8.41 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.65 -0.704 . . . . 6.3 109.973 179.657 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 92' ' ' SER . . . . . 0.4 ' O ' ' HA ' ' B' ' 71' ' ' VAL . 8.6 m -84.73 127.18 33.98 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.366 -0.379 . . . . 6.65 111.939 -178.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -125.24 131.0 53.2 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.21 -0.45 . . . . 6.45 109.904 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . 0.446 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.0 OUTLIER -89.28 114.36 25.72 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.472 -0.331 . . . . 9.17 110.797 179.644 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -102.45 122.81 45.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.917 0.389 . . . . 8.33 110.423 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -106.6 147.65 29.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.968 -0.56 . . . . 10.53 110.533 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 97' ' ' ASN . . . . . 0.432 ' HB3' ' CD2' ' B' ' 99' ' ' TYR . 3.4 m-80 -85.11 147.25 47.26 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 115.972 -0.558 . . . . 8.43 110.221 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -78.61 49.83 3.21 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.8 2.333 . . . . 9.16 112.999 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . 0.432 ' CD2' ' HB3' ' B' ' 97' ' ' ASN . 51.3 m-85 -128.71 -58.14 1.17 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.999 0.428 . . . . 11.34 110.366 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.13 21.01 2.8 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.191 -0.459 . . . . 7.75 110.538 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 32.7 t70 62.83 32.76 15.7 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.779 0.8 . . . . 9.08 110.005 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -85.7 140.42 30.54 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.481 -0.781 . . . . 7.71 110.783 -179.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 25.5 mt -84.94 117.74 30.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.322 -0.399 . . . . 8.04 110.028 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -75.7 -46.37 31.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.909 0.385 . . . . 8.81 110.045 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -165.49 172.48 12.05 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.796 -0.638 . . . . 7.4 109.643 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 54.3 mt -106.37 115.89 48.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 109.952 -0.388 . . . . 6.78 109.952 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.495 HG23 HG13 ' B' ' 13' ' ' ILE . 77.0 mt -81.9 105.55 11.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.753 -0.658 . . . . 6.31 109.741 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 108' ' ' CYS . . . . . 0.545 ' HB3' ' CG2' ' B' ' 90' ' ' THR . 94.4 m -107.85 99.0 8.51 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 120.863 0.363 . . . . 5.31 111.948 -179.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 94.4 m -75.64 105.54 6.73 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.413 -0.958 . . . . 5.48 108.413 177.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 110' ' ' ASN . . . . . 0.634 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 3.7 m-20 -81.85 101.18 10.03 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.718 -0.674 . . . . 6.9 111.671 -178.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 20.4 m -101.56 107.43 18.71 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.814 -0.63 . . . . 8.61 110.301 179.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 112' ' ' ASN . . . . . 0.424 HD22 HD13 ' B' ' 86' ' ' LEU . 8.9 t-20 -70.86 135.76 48.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.787 0.327 . . . . 11.84 110.502 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 37.1 t -113.37 -53.46 5.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.005 -0.543 . . . . 11.77 110.009 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . 0.79 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 46.4 mtpt . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.283 -0.865 . . . . 12.68 109.817 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 78.6 mm-40 . . . . . 0 N--CA 1.453 -0.301 0 N-CA-C 109.582 -0.525 . . . . 15.08 109.582 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -61.12 150.83 82.5 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 123.089 2.526 . . . . 13.43 112.32 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.812 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.0 OUTLIER -82.96 51.39 1.92 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.27 0.557 . . . . 11.09 110.8 -179.861 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.632 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 30.7 tt0 -153.71 116.26 4.42 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.602 -0.888 . . . . 10.59 108.602 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.998 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 41.3 p90 -130.95 166.39 21.07 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.984 0.421 . . . . 8.93 111.579 -178.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.559 HD13 HG23 ' A' ' 109' ' ' THR . 30.9 mm -94.77 121.28 45.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.854 -0.612 . . . . 8.66 110.665 -179.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.626 ' HB3' ' HE2' ' A' ' 22' ' ' PHE . 0.7 OUTLIER -106.54 97.1 6.93 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.159 -0.473 . . . . 6.11 110.878 179.588 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.439 ' HB2' ' HB3' ' A' ' 24' ' ' PHE . 3.5 mtt180 -83.17 102.41 11.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.763 -0.829 . . . . 9.09 108.763 178.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.446 ' O ' ' HB2' ' A' ' 105' ' ' TYR . 34.4 p80 -132.18 158.7 41.03 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 121.149 -0.22 . . . . 9.79 111.265 -178.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -77.92 178.23 7.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.487 -0.324 . . . . 12.69 110.235 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 22.2 pt -54.55 -37.04 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 113.374 0.879 . . . . 13.58 113.374 -178.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -73.17 -25.66 60.88 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.039 0.447 . . . . 13.85 111.568 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 116.35 1.09 20.39 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.449 -0.882 . . . . 9.38 112.198 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.434 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 37.0 mm -67.89 114.37 4.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 109.728 -0.471 . . . . 10.74 109.728 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.626 ' HE2' ' HB3' ' A' ' 14' ' ' SER . 78.8 m-85 -67.32 126.27 28.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.143 -0.48 . . . . 9.73 110.907 -179.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.2 m -106.29 -26.02 11.7 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.68 -0.691 . . . . 7.74 109.754 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . 0.46 ' HE2' ' HE1' ' B' ' 95' ' ' PHE . 78.1 t80 -152.42 116.2 4.83 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.646 -0.706 . . . . 6.92 109.615 179.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.604 HG21 ' HB2' ' A' ' 40' ' ' LEU . 19.3 t -112.27 127.48 69.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.347 -0.388 . . . . 6.02 110.763 -179.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.998 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 10.1 t70 -66.38 136.28 55.54 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.145 -0.48 . . . . 7.31 110.08 179.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -57.61 -16.3 9.99 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.896 0.702 . . . . 11.67 112.896 -179.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.472 ' HB2' ' HB3' ' A' ' 12' ' ' PHE . 80.1 mtm180 -67.95 -10.57 54.51 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.216 -0.302 . . . . 11.91 111.077 179.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 29.1 p -59.89 -31.46 69.82 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.726 0.298 . . . . 12.99 110.914 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 20.4 t -65.01 -36.55 78.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.185 -0.461 . . . . 16.15 110.823 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.05 -16.27 38.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.933 0.397 . . . . 15.07 110.922 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.79 ' HA ' HG22 ' A' ' 10' ' ' THR . 25.8 m -87.97 -56.64 3.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.019 -0.537 . . . . 14.9 111.594 -179.579 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.65 ' HB ' ' HA ' ' A' ' 80' ' ' SER . 7.7 m -121.47 -19.41 4.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 111.924 0.342 . . . . 13.84 111.924 -179.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.2 -18.27 56.82 Favored Glycine 0 N--CA 1.454 -0.145 0 C-N-CA 120.602 -0.809 . . . . 13.85 112.273 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.461 ' H ' HG23 ' A' ' 33' ' ' VAL . 5.7 m-85 -66.37 136.92 56.46 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.624 0.249 . . . . 18.28 110.483 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.481 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 33.6 mm-40 -76.24 150.6 83.01 Favored Pre-proline 0 C--N 1.326 -0.437 0 N-CA-C 109.37 -0.604 . . . . 15.48 109.37 179.207 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.537 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 52.6 Cg_exo -52.47 -41.97 64.27 Favored 'Trans proline' 0 CA--C 1.527 0.162 0 C-N-CA 122.529 2.153 . . . . 11.63 112.528 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.487 ' HA ' HD12 ' A' ' 41' ' ' LEU . 23.4 mp0 -69.24 -19.19 63.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.025 -0.534 . . . . 13.31 111.839 -179.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.481 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 36.7 mt-10 -73.45 -24.05 60.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.945 0.402 . . . . 17.34 110.426 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.604 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.8 mm? -93.45 -28.49 16.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.071 -0.513 . . . . 13.25 110.286 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 91.8 mt -61.17 131.8 51.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.925 -0.579 . . . . 12.99 110.772 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 75.99 11.72 84.54 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.928 -0.653 . . . . 13.39 112.681 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.783 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 7.9 mmpt? -129.47 159.61 35.74 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.696 0.284 . . . . 16.87 110.388 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.4 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 13.3 m120 -94.02 138.23 32.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.157 -0.474 . . . . 12.5 110.197 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.41 HG13 ' HE1' ' A' ' 78' ' ' PHE . 17.2 tt -60.25 -25.7 34.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.013 -0.539 . . . . 11.72 111.3 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.8 p -68.38 -20.84 25.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 116.342 -0.39 . . . . 12.89 111.413 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.4 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 39.1 mt-10 -76.99 -23.62 52.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.048 0.451 . . . . 16.53 110.4 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -106.11 15.09 26.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.885 -0.598 . . . . 15.34 109.984 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 17.1 t -106.62 147.98 28.86 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.461 -0.79 . . . . 11.97 110.843 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.415 ' CD2' ' HD2' ' A' ' 51' ' ' PRO . 7.4 t-160 -57.76 127.76 79.19 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 115.58 -0.736 . . . . 14.67 109.36 178.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.415 ' HD2' ' CD2' ' A' ' 50' ' ' HIS . 80.7 Cg_exo -45.18 -52.17 6.82 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.475 2.783 . . . . 15.15 113.976 -179.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -67.67 -8.91 38.77 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.315 0.487 . . . . 16.47 112.315 -179.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.542 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 27.8 m-20 -114.84 -1.48 13.18 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.793 0.33 . . . . 13.16 110.893 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.402 ' OE1' ' HA ' ' A' ' 51' ' ' PRO . 83.5 mt-30 -62.39 -46.2 89.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.24 -0.436 . . . . 15.83 111.099 -179.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -63.01 -38.19 90.19 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.64 -0.504 . . . . 13.94 109.64 178.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.3 tp -61.7 -43.35 99.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.626 -0.716 . . . . 12.11 109.925 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.438 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.3 OUTLIER -63.99 -52.52 59.2 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.781 -0.645 . . . . 9.71 110.706 179.487 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 33.6 ttt180 -58.22 -46.3 86.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.319 -0.4 . . . . 11.06 111.385 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.473 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 34.7 t70 -61.5 -45.58 93.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.71 -0.223 . . . . 9.71 110.914 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 45.2 m -63.61 -37.53 87.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.972 0.415 . . . . 9.52 110.557 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.5 ' O ' HG23 ' A' ' 65' ' ' VAL . 2.8 m-30 -63.3 -37.33 86.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.106 -0.497 . . . . 11.4 109.993 178.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 -73.32 -33.06 64.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.182 -0.463 . . . . 10.04 109.92 178.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.473 ' HG3' ' O ' ' A' ' 59' ' ' ASP . 52.9 mt-30 -63.53 -45.33 91.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.878 -0.601 . . . . 10.6 110.991 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.499 HG12 ' O ' ' A' ' 61' ' ' PHE . 6.3 p -65.29 -25.23 36.71 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-N 116.538 -0.301 . . . . 10.62 111.472 -179.231 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 61' ' ' PHE . 79.5 t -70.82 -32.77 50.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 109.405 -0.591 . . . . 12.41 109.405 178.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 34.8 mtpt -82.56 -18.31 41.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.43 -0.805 . . . . 16.25 110.245 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 92.1 mt -83.03 -54.16 5.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.012 -0.54 . . . . 12.66 109.967 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 57.6 mttt 61.4 94.98 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.914 0.759 . . . . 14.83 112.814 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 107.17 -25.48 21.87 Favored Glycine 0 N--CA 1.454 -0.109 0 C-N-CA 120.423 -0.894 . . . . 9.8 113.753 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -90.33 131.54 36.07 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.156 -0.313 . . . . 9.59 110.156 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.46 ' HB ' ' HZ ' ' B' ' 24' ' ' PHE . 3.7 p -77.54 113.07 16.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.269 0.557 . . . . 8.1 110.491 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 33.3 tp -102.19 100.16 10.34 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.038 -0.528 . . . . 7.8 110.602 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.429 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 0.0 OUTLIER -81.66 115.01 20.72 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.607 -0.724 . . . . 7.59 110.363 179.478 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 p -109.52 122.95 64.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.915 0.388 . . . . 7.84 110.172 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 27.7 ttt -97.17 111.96 23.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.261 -0.427 . . . . 9.35 111.065 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.542 ' HB2' ' HB3' ' A' ' 53' ' ' ASP . 48.3 p90 -140.49 -173.47 3.69 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.195 -0.669 . . . . 9.66 109.195 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.455 ' HB3' ' HB3' ' A' ' 85' ' ' TRP . 12.9 mtm180 -105.59 122.17 45.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.105 0.479 . . . . 13.1 110.649 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.41 ' HE1' HG13 ' A' ' 45' ' ' ILE . 23.1 t80 -104.27 152.61 22.01 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.671 -0.695 . . . . 9.28 110.203 -179.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.616 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 46.9 ttp180 -92.83 128.43 38.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.871 0.367 . . . . 10.87 111.018 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.65 ' HA ' ' HB ' ' A' ' 33' ' ' VAL . 77.5 p -90.76 -176.63 4.75 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.698 -0.482 . . . . 10.77 109.698 179.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.443 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 40.3 tptt -71.41 -12.2 61.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.376 0.608 . . . . 12.66 109.614 178.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -90.84 2.98 55.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.404 -0.816 . . . . 14.42 109.342 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 65.24 23.72 12.22 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 115.029 -0.987 . . . . 12.69 111.104 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.494 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.6 pt-20 -99.2 160.15 14.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 10.85 109.888 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.616 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 64.8 m95 -106.47 110.66 22.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.521 -0.309 . . . . 11.2 110.638 -179.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.432 ' H ' ' HG ' ' A' ' 86' ' ' LEU . 0.8 OUTLIER -113.72 154.94 26.47 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.264 -0.426 . . . . 11.12 110.072 179.643 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.437 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 97.9 m95 -75.04 120.5 20.65 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.247 0.546 . . . . 10.28 111.416 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 47.8 tpp -119.44 130.71 55.4 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.221 -0.9 . . . . 9.32 110.416 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.515 ' HB3' ' HB ' ' A' ' 111' ' ' THR . 3.1 ttp180 -101.87 73.97 1.44 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.042 -0.725 . . . . 10.66 109.042 178.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.644 HG23 ' HB3' ' A' ' 108' ' ' CYS . 52.3 m -64.34 114.43 4.27 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.694 -0.685 . . . . 9.37 111.651 -179.242 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.595 ' O ' ' HA ' ' A' ' 108' ' ' CYS . 0.7 OUTLIER -89.75 94.45 9.84 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.385 -0.825 . . . . 8.27 109.873 179.948 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.431 ' HA ' ' SG ' ' A' ' 108' ' ' CYS . 5.3 m -77.5 117.45 18.96 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.982 0.42 . . . . 8.65 111.532 -179.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -122.91 117.55 25.82 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.837 -0.619 . . . . 11.56 109.77 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.56 127.75 33.6 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.227 -0.442 . . . . 10.16 111.664 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -104.03 118.53 36.89 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.586 -0.524 . . . . 12.25 109.586 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -108.54 149.17 29.22 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.215 0.531 . . . . 14.24 111.928 -178.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.47 ' HA ' ' HD3' ' A' ' 98' ' ' PRO . 12.0 t-20 -97.19 132.89 24.75 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 115.36 -0.836 . . . . 13.83 109.612 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' A' ' 97' ' ' ASN . 27.5 Cg_exo -63.27 -6.31 9.74 Favored 'Trans proline' 0 N--CA 1.476 0.486 0 C-N-CA 123.358 2.705 . . . . 15.34 114.467 -178.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -62.84 -61.51 2.36 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.643 0.258 . . . . 16.89 110.436 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -145.31 27.95 1.23 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.736 0.303 . . . . 14.89 111.0 179.096 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 27.7 t70 63.52 41.9 7.0 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.529 -0.759 . . . . 14.77 111.782 179.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -91.36 142.47 27.65 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.351 -0.386 . . . . 12.95 110.067 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 48.9 mt -88.75 102.3 12.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.047 -0.353 . . . . 11.11 110.047 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.482 ' H ' ' HG2' ' A' ' 104' ' ' GLU . 2.5 pt-20 -71.26 -41.37 70.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.71 0.291 . . . . 11.65 110.974 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.446 ' HB2' ' O ' ' A' ' 16' ' ' HIS . 20.6 p90 -161.6 178.96 8.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.777 0.322 . . . . 10.3 110.642 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 44.4 mt -122.24 123.24 68.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.092 -0.504 . . . . 10.29 110.634 -179.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.626 HG21 HH22 ' B' ' 15' ' ' ARG . 85.8 mt -91.12 112.7 25.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.11 -0.7 . . . . 8.99 109.11 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.644 ' HB3' HG23 ' A' ' 90' ' ' THR . 96.8 m -113.76 116.59 29.63 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.372 0.508 . . . . 9.83 112.372 -178.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.559 HG23 HD13 ' A' ' 13' ' ' ILE . 0.2 OUTLIER -82.92 110.55 18.0 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.69 -0.856 . . . . 10.84 108.69 177.865 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.632 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 3.9 m-20 -85.56 98.33 10.58 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.882 0.372 . . . . 11.26 111.448 -178.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.515 ' HB ' ' HB3' ' A' ' 89' ' ' ARG . 1.3 m -93.75 110.55 22.18 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.756 -0.657 . . . . 11.22 111.165 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . 0.812 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 3.8 t-20 -75.64 111.93 11.48 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.588 -0.523 . . . . 12.78 109.588 178.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . 0.486 HG12 ' HG3' ' A' ' 114' ' ' LYS . 39.5 t -91.4 -53.41 8.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 116.072 -0.513 . . . . 14.64 110.488 -179.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.486 ' HG3' HG12 ' A' ' 113' ' ' VAL . 54.7 mtpt . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.406 -0.806 . . . . 16.02 110.056 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 18.8 m . . . . . 0 N--CA 1.478 0.96 0 CA-C-O 120.716 0.294 . . . . 7.49 110.295 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' GLN . . . . . 0.749 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 33.5 mm-40 -75.81 146.18 79.24 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.386 -0.37 . . . . 7.12 110.94 -179.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' B' ' 8' ' ' GLN . 5.5 Cg_exo -80.54 -167.41 0.5 Allowed 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 123.276 2.651 . . . . 6.18 112.812 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . 0.738 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.1 OUTLIER -99.32 47.04 0.96 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.218 0.532 . . . . 5.81 110.936 -179.707 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.503 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -151.76 151.53 31.51 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.543 -0.91 . . . . 5.85 108.543 179.593 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' PHE . . . . . 0.631 ' HB2' ' HB3' ' B' ' 26' ' ' ASP . 18.8 p90 -161.32 158.72 27.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.412 0.625 . . . . 6.08 112.019 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.539 HG13 HG21 ' A' ' 109' ' ' THR . 24.7 mm -85.51 118.81 32.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.091 -0.959 . . . . 5.57 110.542 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.443 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.8 OUTLIER -112.79 89.2 3.01 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.199 -0.455 . . . . 5.3 110.761 179.9 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . 0.626 HH22 HG21 ' A' ' 107' ' ' ILE . 8.1 mtp180 -83.4 110.83 18.48 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.387 -0.597 . . . . 8.97 109.387 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . 0.522 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 33.6 p80 -136.68 162.53 32.9 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.548 -0.296 . . . . 8.31 110.616 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -78.14 174.97 10.59 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.208 -0.293 . . . . 10.83 110.208 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 27.0 pt -59.71 -24.11 28.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 113.109 0.781 . . . . 8.89 113.109 -178.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -77.54 -22.01 51.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.935 0.398 . . . . 11.92 110.981 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 112.72 -7.82 25.94 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.558 -0.83 . . . . 8.57 112.368 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 33.9 mm -69.71 116.71 11.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 110.186 -0.301 . . . . 10.87 110.186 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . 0.522 ' HA ' ' HB3' ' B' ' 16' ' ' HIS . 94.7 m-85 -66.13 121.4 15.07 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.091 -0.504 . . . . 8.23 111.106 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -92.19 -40.25 11.11 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.779 -0.646 . . . . 7.91 110.363 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . 0.46 ' HZ ' ' HB ' ' A' ' 71' ' ' VAL . 47.6 t80 -155.44 120.87 4.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.101 -0.499 . . . . 7.89 110.29 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 10.6 m -115.86 154.68 17.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.032 0.444 . . . . 6.1 111.218 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . 0.631 ' HB3' ' HB2' ' B' ' 12' ' ' PHE . 9.2 t70 -74.47 165.03 25.88 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.428 -0.806 . . . . 7.15 110.233 179.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 4.2 m170 -82.27 -8.7 59.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.838 0.352 . . . . 8.97 110.981 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . 0.749 ' HG2' ' HB3' ' B' ' 8' ' ' GLN . 72.1 mtm180 -69.1 -14.62 63.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.006 -0.543 . . . . 9.76 111.974 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 28.4 p -57.28 -31.66 65.84 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 111.725 0.269 . . . . 11.56 111.725 -178.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . 0.423 HG13 HE22 ' B' ' 36' ' ' GLN . 25.1 t -63.05 -38.74 82.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.205 -0.452 . . . . 13.64 111.108 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.04 -17.57 30.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.771 0.32 . . . . 12.9 110.968 179.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 41.5 m -80.39 -58.82 2.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.167 -0.47 . . . . 12.13 111.849 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' VAL . . . . . 0.505 ' HB ' ' HA ' ' B' ' 80' ' ' SER . 3.5 m -127.68 -2.07 3.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 112.24 0.459 . . . . 13.87 112.24 -178.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.29 -19.94 28.85 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.705 -0.759 . . . . 13.79 112.564 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' TYR . . . . . 0.442 ' HB2' HG23 ' B' ' 33' ' ' VAL . 4.2 m-85 -62.95 129.63 41.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.708 0.29 . . . . 15.38 110.668 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . 0.588 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 40.4 mm-40 -73.74 151.89 89.1 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 109.54 -0.541 . . . . 13.78 109.54 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.504 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 61.3 Cg_exo -51.58 -38.86 65.85 Favored 'Trans proline' 0 CA--C 1.53 0.32 0 C-N-CA 122.757 2.304 . . . . 14.71 112.778 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 24.3 mp0 -71.44 -13.38 61.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.883 -0.599 . . . . 17.54 111.821 -179.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.588 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 30.4 mt-10 -85.14 -19.8 31.24 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.8 0.333 . . . . 14.24 110.293 179.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -92.24 -45.1 8.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.016 -0.538 . . . . 14.03 110.377 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 51.5 mt -58.56 126.39 27.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.009 -0.541 . . . . 13.62 111.211 -179.249 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.53 -5.16 83.99 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.778 -0.646 . . . . 11.62 112.261 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.804 ' HE2' ' HA ' ' B' ' 43' ' ' LYS . 6.7 mmpt? -112.05 160.05 17.87 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 122.758 -0.26 . . . . 13.82 110.433 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' ASN . . . . . 0.826 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 17.7 m120 -92.61 138.12 31.78 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.601 -0.518 . . . . 10.16 109.601 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . 0.438 ' HB ' ' CZ ' ' B' ' 22' ' ' PHE . 14.4 tt -62.9 -28.07 44.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.034 0.445 . . . . 9.62 111.055 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 5.1 p -71.5 -18.64 20.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-N 116.224 -0.444 . . . . 11.5 111.72 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . 0.826 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 42.9 mt-10 -69.57 -37.41 76.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.902 0.382 . . . . 11.89 110.968 -179.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 -98.74 18.19 17.53 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.023 0.439 . . . . 13.6 110.405 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 41.1 t -101.65 145.67 28.77 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.888 -0.596 . . . . 10.81 110.616 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' HIS . . . . . 0.482 ' CD2' ' HD2' ' B' ' 51' ' ' PRO . 5.5 t-160 -55.64 128.61 69.32 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.537 -0.756 . . . . 11.49 109.92 178.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' PRO . . . . . 0.482 ' HD2' ' CD2' ' B' ' 50' ' ' HIS . 95.7 Cg_exo -44.57 -51.72 6.81 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 123.516 2.811 . . . . 11.35 113.628 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -70.07 -4.19 19.98 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.184 0.439 . . . . 9.28 112.184 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . 0.435 ' HB3' ' HB2' ' B' ' 76' ' ' PHE . 53.5 m-20 -120.54 -0.32 10.32 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.866 0.365 . . . . 7.52 110.502 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -62.72 -43.51 98.62 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.97 -0.559 . . . . 6.57 111.209 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 48.6 tp60 -69.41 -39.31 77.97 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.425 -0.352 . . . . 6.58 110.189 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 58.0 tp -59.64 -39.81 85.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 4.6 110.483 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.42 HD22 ' CZ ' ' B' ' 61' ' ' PHE . 0.7 OUTLIER -62.85 -50.42 71.0 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.003 -0.544 . . . . 6.4 110.33 179.267 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 52.8 ttt180 -61.43 -43.45 98.85 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.103 -0.499 . . . . 8.18 110.923 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . 0.444 ' O ' ' HG3' ' B' ' 63' ' ' GLN . 25.3 t70 -60.0 -46.52 89.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.812 0.339 . . . . 6.07 110.296 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 36.6 m -61.42 -34.2 74.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.959 -0.564 . . . . 5.59 110.426 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 61' ' ' PHE . . . . . 0.49 ' O ' HG12 ' B' ' 64' ' ' VAL . 10.7 m-85 -65.35 -39.8 92.82 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.295 0.569 . . . . 7.73 109.535 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -67.4 -35.55 79.52 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.802 -0.636 . . . . 6.89 110.171 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' B' ' 59' ' ' ASP . 34.8 mt-30 -69.28 -44.51 71.69 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.941 -0.572 . . . . 9.4 111.514 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.56 ' HA ' HD12 ' B' ' 67' ' ' LEU . 9.9 p -63.49 -29.22 46.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-O 120.719 0.295 . . . . 7.57 110.692 -179.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . 0.686 ' HA ' HG21 ' B' ' 94' ' ' THR . 61.3 t -70.44 -35.48 62.24 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.1 0 N-CA-C 109.638 -0.505 . . . . 7.43 109.638 178.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -67.66 -39.97 84.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.843 -0.617 . . . . 10.21 110.039 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.56 HD12 ' HA ' ' B' ' 64' ' ' VAL . 25.6 mt -66.17 -49.0 68.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.564 -0.744 . . . . 7.2 110.082 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 14.6 tttt 60.75 98.41 0.03 OUTLIER 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.474 -0.785 . . . . 7.58 112.228 179.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.83 20.36 34.16 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.751 -0.738 . . . . 5.57 112.427 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -124.89 154.06 41.67 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.569 -0.53 . . . . 5.43 109.569 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 71' ' ' VAL . . . . . 0.589 ' CG2' ' HB3' ' B' ' 91' ' ' SER . 2.7 p -103.96 117.36 49.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-O 121.283 0.564 . . . . 5.65 110.582 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 13.0 tp -108.86 111.05 22.56 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.773 -0.649 . . . . 4.51 110.09 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . 0.575 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 12.7 m -87.06 112.18 21.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.233 -0.44 . . . . 6.35 111.117 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.2 p -108.82 131.19 60.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.039 -0.528 . . . . 4.34 110.061 179.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 25.4 ttt -100.85 115.11 29.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.077 0.465 . . . . 5.42 110.912 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.483 ' HE1' ' HB ' ' B' ' 90' ' ' THR . 50.7 p90 -143.99 178.17 8.04 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.649 -0.705 . . . . 3.54 109.456 179.662 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 77' ' ' ARG . . . . . 0.56 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 12.1 mtm180 -101.09 122.23 43.21 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.998 0.428 . . . . 6.8 110.112 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.432 ' HD1' ' HE2' ' B' ' 76' ' ' PHE . 25.5 t80 -105.78 145.81 30.68 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.604 -0.726 . . . . 5.79 110.119 -179.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 79' ' ' ARG . . . . . 0.547 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 30.4 ttt180 -87.22 122.35 30.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.141 -0.481 . . . . 11.08 110.782 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . 0.505 ' HA ' ' HB ' ' B' ' 33' ' ' VAL . 76.5 p -86.37 -176.81 6.03 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.085 -0.507 . . . . 7.47 109.746 179.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . 0.417 ' HA ' ' HD2' ' B' ' 81' ' ' LYS . 35.5 tptt -70.63 -13.06 61.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.496 0.665 . . . . 12.24 109.581 178.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -88.61 0.03 56.79 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.595 -0.73 . . . . 9.25 109.626 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 69.76 20.19 6.93 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.393 -0.821 . . . . 8.3 110.832 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . 0.435 ' O ' ' HA ' ' B' ' 79' ' ' ARG . 2.8 pt-20 -98.94 151.4 20.93 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.348 -0.387 . . . . 6.78 110.118 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . 0.56 ' HB3' ' HB3' ' B' ' 77' ' ' ARG . 44.2 m95 -100.76 103.2 14.43 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.246 -0.434 . . . . 7.89 110.587 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.43 ' H ' ' HG ' ' B' ' 86' ' ' LEU . 0.8 OUTLIER -103.46 151.84 22.35 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.221 -0.445 . . . . 6.97 110.346 179.642 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 87' ' ' TRP . . . . . 0.684 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 89.7 m95 -76.37 114.4 15.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.246 0.546 . . . . 8.55 110.759 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 21.4 tpp -115.21 129.89 56.77 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.216 -0.902 . . . . 4.46 110.792 -178.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 -99.49 85.07 3.08 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.566 -0.901 . . . . 6.87 108.566 178.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 90' ' ' THR . . . . . 0.492 HG23 ' HB3' ' B' ' 108' ' ' CYS . 22.7 m -78.82 113.19 16.7 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.759 -0.655 . . . . 6.18 111.86 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 91' ' ' SER . . . . . 0.629 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 20.3 m -93.66 87.7 5.58 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.63 -0.714 . . . . 6.3 109.815 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 92' ' ' SER . . . . . 0.57 ' HA ' ' HA ' ' B' ' 108' ' ' CYS . 14.4 m -72.74 128.75 36.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.903 -0.59 . . . . 6.65 111.419 -178.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -122.71 126.41 47.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.106 -0.497 . . . . 6.45 110.021 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . 0.686 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.1 OUTLIER -83.3 107.7 16.01 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.709 0.29 . . . . 9.17 110.501 179.406 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 95' ' ' PHE . . . . . 0.46 ' HE1' ' HE2' ' A' ' 24' ' ' PHE . 0.3 OUTLIER -86.27 129.73 34.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.381 -0.372 . . . . 8.33 110.558 -179.466 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -108.48 131.51 54.74 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.011 -0.54 . . . . 10.53 111.028 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 97' ' ' ASN . . . . . 0.43 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 55.9 t30 -71.49 127.9 90.59 Favored Pre-proline 0 C--N 1.32 -0.706 0 N-CA-C 108.866 -0.79 . . . . 8.43 108.866 178.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 98' ' ' PRO . . . . . 0.43 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 57.4 Cg_endo -70.37 45.39 0.52 Allowed 'Trans proline' 0 CA--C 1.534 0.501 0 C-N-CA 123.175 2.583 . . . . 9.16 113.137 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -126.53 -54.22 1.45 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.44 -0.345 . . . . 11.34 110.702 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 48.5 m -137.11 21.43 3.01 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.745 -0.207 . . . . 7.75 111.201 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 25.4 t70 64.8 20.2 12.06 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 121.525 0.679 . . . . 9.08 110.492 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 4.3 pm0 -79.95 142.51 35.01 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.083 -0.508 . . . . 7.71 110.477 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 80.8 mt -76.53 110.86 12.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.751 -0.463 . . . . 8.04 109.751 179.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.435 ' H ' ' HG2' ' B' ' 104' ' ' GLU . 5.7 pt-20 -73.04 -45.09 59.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.555 -0.293 . . . . 8.81 110.468 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -168.56 165.61 12.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.939 0.4 . . . . 7.4 110.758 179.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 32.7 mt -101.36 113.52 37.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.883 -0.599 . . . . 6.78 109.667 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.529 HG12 ' HG2' ' B' ' 15' ' ' ARG . 64.2 mt -88.72 100.33 10.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.917 -0.583 . . . . 6.31 110.005 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 108' ' ' CYS . . . . . 0.57 ' HA ' ' HA ' ' B' ' 92' ' ' SER . 54.0 m -88.38 106.87 18.53 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.106 0.479 . . . . 5.31 111.204 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . 0.629 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 0.4 OUTLIER -81.39 87.03 6.19 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.273 -0.64 . . . . 5.48 109.273 178.576 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 110' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -69.61 141.47 53.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.692 -0.686 . . . . 6.9 110.6 -178.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 2.6 m -149.47 113.53 5.16 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.107 -0.331 . . . . 8.61 110.107 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 112' ' ' ASN . . . . . 0.738 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 17.7 t-20 -70.08 133.38 47.11 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.195 0.521 . . . . 11.84 110.987 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 113' ' ' VAL . . . . . 0.476 HG12 ' HG3' ' B' ' 114' ' ' LYS . 66.2 t -113.6 -51.25 5.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.557 -0.747 . . . . 11.77 109.359 179.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . 0.684 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 61.0 mtpt . . . . . 0 C--O 1.246 0.871 0 CA-C-O 118.369 -0.825 . . . . 12.68 109.609 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 . . . . . 0 N--CA 1.451 -0.417 0 N-CA-C 109.836 -0.431 . . . . 15.08 109.836 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.8 154.49 58.83 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.598 2.198 . . . . 13.43 112.164 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.846 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.7 OUTLIER -79.92 56.09 2.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.493 0.663 . . . . 11.09 110.516 179.593 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.513 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 15.6 tt0 -157.12 117.78 3.58 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.058 -0.974 . . . . 10.59 108.939 -178.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.868 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 35.7 p90 -140.77 162.14 36.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.365 0.602 . . . . 8.93 112.191 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.453 HG23 HG23 ' A' ' 107' ' ' ILE . 42.8 mm -93.99 124.93 46.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.467 -0.788 . . . . 8.66 110.802 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.586 ' HB3' ' HE1' ' A' ' 22' ' ' PHE . 2.4 m -115.14 105.77 13.31 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.27 -0.423 . . . . 6.11 110.934 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -89.97 112.58 24.03 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.278 -0.638 . . . . 9.09 109.278 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.2 p80 -139.22 159.9 41.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.474 0.178 . . . . 9.79 110.991 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -77.98 174.9 10.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.443 -0.344 . . . . 12.69 110.226 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 14.9 pt -57.32 -27.92 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 N-CA-C 113.236 0.828 . . . . 13.58 113.236 -178.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -80.44 -17.91 50.33 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.107 0.48 . . . . 13.85 111.453 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 110.11 0.1 29.94 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.506 -0.854 . . . . 9.38 112.793 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ILE . . . . . 0.482 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 30.9 mm -72.73 118.42 17.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.719 -0.474 . . . . 10.74 109.719 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.586 ' HE1' ' HB3' ' A' ' 14' ' ' SER . 90.1 m-85 -72.07 124.91 25.96 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.059 0.457 . . . . 9.73 111.924 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -97.39 -29.2 13.64 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.365 -0.834 . . . . 7.74 110.078 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -158.27 125.54 5.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.714 -0.676 . . . . 6.92 110.01 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.482 HG21 ' HB2' ' A' ' 40' ' ' LEU . 9.5 t -118.96 134.82 61.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.407 -0.36 . . . . 6.02 111.006 -179.376 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.868 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 9.7 t70 -66.26 139.41 58.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.011 -0.54 . . . . 7.31 109.771 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -62.77 -14.23 42.51 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.332 0.493 . . . . 11.67 112.332 -179.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.429 ' HB2' ' HB3' ' A' ' 12' ' ' PHE . 79.7 mtm180 -69.04 -10.97 60.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.675 0.274 . . . . 11.91 111.282 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 27.8 p -60.6 -31.98 71.12 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.765 0.317 . . . . 12.99 110.515 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.59 HG13 HE22 ' A' ' 36' ' ' GLN . 42.5 t -62.04 -35.3 67.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.77 -0.65 . . . . 16.15 111.296 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -91.25 -8.1 49.35 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.825 0.345 . . . . 15.07 111.69 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.694 ' HA ' HG22 ' A' ' 10' ' ' THR . 24.7 m -97.13 -55.23 2.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.856 0.36 . . . . 14.9 111.322 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.419 HG12 HD21 ' A' ' 86' ' ' LEU . 2.9 m -117.18 -13.61 10.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.405 -0.361 . . . . 13.84 111.741 -179.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.427 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 92.11 -15.15 62.67 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.603 -0.808 . . . . 13.85 112.524 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -75.01 139.01 42.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.564 0.221 . . . . 18.28 110.662 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.59 HE22 HG13 ' A' ' 30' ' ' VAL . 33.9 mm-40 -80.59 149.8 68.8 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.394 -0.595 . . . . 15.48 109.394 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.592 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 51.2 Cg_exo -54.8 -37.41 92.27 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.411 2.074 . . . . 11.63 112.388 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.494 ' HA ' HD12 ' A' ' 41' ' ' LEU . 15.5 mp0 -69.77 -19.07 63.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.125 -0.489 . . . . 13.31 111.347 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.536 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 47.1 mt-10 -82.11 -14.33 55.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.971 0.415 . . . . 17.34 110.37 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.482 ' HB2' HG21 ' A' ' 25' ' ' VAL . 3.2 mm? -101.07 -27.31 13.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.866 -0.606 . . . . 13.25 110.301 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 95.1 mt -60.64 125.54 24.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.947 -0.569 . . . . 12.99 110.673 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 81.54 2.71 90.62 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.872 -0.68 . . . . 13.39 112.366 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.725 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 9.1 mmpt? -111.69 160.49 17.22 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.776 0.322 . . . . 16.87 110.647 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.68 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 16.0 m120 -96.48 135.58 38.16 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.041 -0.527 . . . . 12.5 109.698 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.555 HG13 ' HE1' ' A' ' 78' ' ' PHE . 10.6 tt -59.53 -26.09 33.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.18 0.514 . . . . 11.72 110.947 179.176 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.521 HG12 ' HB3' ' A' ' 44' ' ' ASN . 9.9 p -69.93 -22.18 24.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 115.716 -0.675 . . . . 12.89 111.424 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.68 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.5 mt-10 -70.05 -36.06 74.72 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.303 0.573 . . . . 16.53 110.731 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -101.69 34.74 2.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.769 -0.65 . . . . 15.34 110.443 -179.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 36.0 t -120.9 150.25 41.36 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.623 -0.717 . . . . 11.97 110.296 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' HIS . . . . . 0.413 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 7.9 t-160 -58.64 126.23 79.16 Favored Pre-proline 0 C--N 1.329 -0.312 0 N-CA-C 109.147 -0.686 . . . . 14.67 109.147 178.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -44.51 -48.97 9.61 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 123.348 2.699 . . . . 15.15 114.17 -178.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -73.75 -4.5 34.98 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.36 0.504 . . . . 16.47 112.36 -179.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.429 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 9.3 m-20 -115.37 -2.13 12.7 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.947 0.403 . . . . 13.16 111.133 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -63.11 -41.0 99.25 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.92 -0.582 . . . . 15.83 111.156 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.1 tp60 -64.61 -43.33 94.09 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.732 -0.469 . . . . 13.94 109.732 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.8 tp -59.73 -39.34 84.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.756 -0.656 . . . . 12.11 110.139 178.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.469 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.4 OUTLIER -62.91 -51.31 67.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.842 -0.617 . . . . 9.71 110.402 179.421 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.425 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 62.0 ttt180 -63.25 -43.13 98.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.074 -0.512 . . . . 11.06 110.756 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.461 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 33.6 t70 -59.02 -47.98 83.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.273 -0.421 . . . . 9.71 110.475 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.6 m -62.63 -34.96 78.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.967 -0.56 . . . . 9.52 110.524 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.606 ' O ' HG12 ' A' ' 64' ' ' VAL . 3.5 m-30 -63.96 -42.18 97.35 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.872 -0.418 . . . . 11.4 109.872 178.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 58' ' ' ARG . 18.0 mm100 -67.98 -32.73 73.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.305 -0.407 . . . . 10.04 110.12 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 59' ' ' ASP . 39.2 mt-30 -70.73 -38.52 73.58 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.095 -0.502 . . . . 10.6 111.035 179.647 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.606 HG12 ' O ' ' A' ' 61' ' ' PHE . 2.7 p -67.42 -25.84 34.38 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 CA-C-O 120.857 0.36 . . . . 10.62 110.519 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' ' 61' ' ' PHE . 89.7 t -74.94 -21.81 16.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 N-CA-C 108.89 -0.782 . . . . 12.41 108.89 178.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.7 mtpt -86.07 -32.62 21.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.393 -0.821 . . . . 16.25 109.489 178.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.833 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 82.0 mt -69.06 -54.87 12.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.586 -0.733 . . . . 12.66 110.538 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 95.1 mttt 59.67 97.59 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.977 0.798 . . . . 14.83 112.325 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.28 -12.38 68.11 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.647 -0.787 . . . . 9.8 112.235 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.833 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 6.7 tp-100 -99.2 137.22 38.02 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.322 -0.621 . . . . 9.59 109.322 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.473 ' HB ' ' HZ ' ' B' ' 24' ' ' PHE . 3.9 p -88.88 121.93 39.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.3 0.572 . . . . 8.1 110.792 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 41.0 tp -109.45 115.49 30.05 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.699 -0.682 . . . . 7.8 109.734 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.3 m -92.46 104.17 16.52 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.113 -0.494 . . . . 7.59 111.031 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.445 HG13 ' HB ' ' A' ' 90' ' ' THR . 2.4 p -96.98 125.29 50.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.017 -0.538 . . . . 7.84 109.803 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 18.5 ttt -100.98 115.43 30.46 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.995 0.426 . . . . 9.35 111.025 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.429 ' HB2' ' HB3' ' A' ' 53' ' ' ASP . 40.6 p90 -146.28 -172.69 4.0 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.478 -0.783 . . . . 9.66 109.116 179.367 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.66 ' HB3' ' HB3' ' A' ' 85' ' ' TRP . 55.9 mtm180 -108.97 118.27 36.36 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.164 0.507 . . . . 13.1 110.833 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.555 ' HE1' HG13 ' A' ' 45' ' ' ILE . 18.2 t80 -96.71 149.63 21.59 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.4 -0.818 . . . . 9.28 110.407 -179.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.614 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 17.1 ttt180 -87.0 121.56 29.64 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.163 -0.471 . . . . 10.87 111.133 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.443 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 60.4 p -88.25 178.63 6.55 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.156 -0.474 . . . . 10.77 110.201 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -70.62 -13.53 62.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.272 0.558 . . . . 12.66 109.934 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -89.97 2.56 54.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.532 -0.758 . . . . 14.42 109.624 179.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 67.34 31.98 6.16 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.415 -0.811 . . . . 12.69 111.046 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.53 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 4.1 pt-20 -108.09 171.47 7.39 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.326 -0.62 . . . . 10.85 109.326 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' TRP . . . . . 0.66 ' HB3' ' HB3' ' A' ' 77' ' ' ARG . 23.7 m95 -120.41 98.57 6.11 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.079 -0.341 . . . . 11.2 110.079 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' A' ' 77' ' ' ARG . 1.1 pp -96.8 151.93 19.17 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.334 -0.393 . . . . 11.12 110.886 -179.435 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.533 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 95.5 m95 -73.93 116.54 14.67 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.257 0.551 . . . . 10.28 110.66 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 36.2 tpp -116.54 131.76 56.86 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.397 -0.82 . . . . 9.32 110.79 -179.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.412 ' HB3' ' HB ' ' A' ' 111' ' ' THR . 5.2 ttp180 -100.87 70.14 1.37 Allowed 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.326 -0.99 . . . . 10.66 108.326 178.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.445 ' HB ' HG13 ' A' ' 74' ' ' VAL . 41.7 m -60.78 107.34 0.68 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.58 -0.736 . . . . 9.37 112.27 -178.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' SER . . . . . 0.493 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 0.7 OUTLIER -86.52 88.92 7.74 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.11 -0.95 . . . . 8.27 109.719 179.407 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 18.7 m -77.92 126.43 30.83 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.135 -0.484 . . . . 8.65 111.369 -179.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -131.12 117.23 18.79 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.864 -0.607 . . . . 11.56 109.887 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.93 118.73 16.23 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.298 -0.41 . . . . 10.16 110.729 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -91.86 119.8 31.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.018 0.437 . . . . 12.25 110.619 -179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.493 ' HG2' HG12 ' A' ' 103' ' ' ILE . 34.0 mt-30 -124.15 167.51 14.16 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.75 -0.659 . . . . 14.24 110.003 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.441 ' HB2' ' HD2' ' A' ' 99' ' ' TYR . 64.1 m-80 -115.89 172.87 3.36 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 109.381 -0.6 . . . . 13.83 109.381 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.418 ' CD ' ' HB3' ' A' ' 97' ' ' ASN . 6.8 Cg_exo -75.69 28.87 0.38 Allowed 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.522 2.148 . . . . 15.34 112.308 178.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' TYR . . . . . 0.441 ' HD2' ' HB2' ' A' ' 97' ' ' ASN . 62.4 m-85 -92.87 -160.6 0.76 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.325 -0.398 . . . . 16.89 110.818 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.2 m -83.26 65.19 8.15 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.613 0.598 . . . . 14.89 112.613 -178.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 41.0 t0 51.01 76.18 0.17 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.646 -0.707 . . . . 14.77 112.45 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.31 165.57 20.29 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.844 -0.617 . . . . 12.95 109.884 179.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.493 HG12 ' HG2' ' A' ' 96' ' ' GLN . 80.1 mt -136.86 120.83 23.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 110.218 -0.289 . . . . 11.11 110.218 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.406 ' H ' ' HG2' ' A' ' 104' ' ' GLU . 5.1 pt-20 -81.16 -44.55 17.71 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.614 -0.434 . . . . 11.65 110.469 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -165.46 178.18 6.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.481 -0.327 . . . . 10.3 110.52 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 40.8 mt -115.57 122.95 70.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.078 -0.51 . . . . 10.29 110.224 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.682 HG21 HH22 ' B' ' 15' ' ' ARG . 61.8 mt -93.21 114.84 30.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.13 -0.486 . . . . 8.99 109.863 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 79.5 m -108.77 119.47 39.62 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.119 0.485 . . . . 9.83 111.423 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.493 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 2.6 m -88.16 101.01 13.4 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.643 -0.873 . . . . 10.84 108.643 178.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . 0.513 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 42.6 m-20 -79.23 104.32 9.77 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.232 -0.44 . . . . 11.26 111.547 -178.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' THR . . . . . 0.412 ' HB ' ' HB3' ' A' ' 89' ' ' ARG . 5.6 m -104.18 118.83 37.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.623 -0.717 . . . . 11.22 110.515 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . 0.846 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 3.5 t-20 -80.82 117.9 21.87 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.015 0.435 . . . . 12.78 110.299 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 18.9 t -97.77 -54.62 6.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.864 -0.607 . . . . 14.64 109.776 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 48.9 mtpt . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.224 -0.893 . . . . 16.02 109.52 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 71.5 m . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 110.108 -0.33 . . . . 7.49 110.108 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' GLN . . . . . 0.938 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 93.0 mm-40 -112.85 150.42 42.79 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 116.529 -0.305 . . . . 7.12 110.828 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.2 174.32 12.67 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 123.015 2.476 . . . . 6.18 113.131 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . 0.508 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.0 OUTLIER -83.56 58.51 4.61 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 116.001 -0.545 . . . . 5.81 111.536 -179.86 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.589 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 7.7 pt-20 -166.42 136.42 3.24 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.173 -0.677 . . . . 5.85 109.173 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' PHE . . . . . 0.41 ' HB3' ' HB2' ' B' ' 28' ' ' ARG . 39.6 p90 -146.12 156.61 43.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.331 0.586 . . . . 6.08 112.005 -179.047 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.503 HG22 ' HG3' ' B' ' 15' ' ' ARG . 28.0 mm -86.08 119.13 33.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.359 -0.837 . . . . 5.57 110.264 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.797 ' HB3' ' HE2' ' B' ' 22' ' ' PHE . 1.2 m -107.13 92.12 3.95 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.963 -0.562 . . . . 5.3 110.507 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' ARG . . . . . 0.682 HH22 HG21 ' A' ' 107' ' ' ILE . 8.5 mtp180 -85.3 102.06 13.06 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.308 -0.627 . . . . 8.97 109.308 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' HIS . . . . . 0.419 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 29.9 p80 -131.43 164.07 26.54 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.236 -0.438 . . . . 8.31 110.872 -179.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -78.2 179.18 7.05 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.318 -0.401 . . . . 10.83 110.621 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 27.3 pt -56.88 -33.32 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 113.252 0.834 . . . . 8.89 113.252 -178.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -76.13 -21.94 56.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.088 0.471 . . . . 11.92 111.382 -179.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 114.05 -4.19 23.97 Favored Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 120.665 -0.779 . . . . 8.57 112.327 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' ILE . . . . . 0.43 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 38.7 mm -67.15 114.26 3.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.939 -0.393 . . . . 10.87 109.939 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' PHE . . . . . 0.797 ' HE2' ' HB3' ' B' ' 14' ' ' SER . 97.3 m-85 -68.48 126.32 29.27 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.168 -0.469 . . . . 8.23 111.242 -179.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 3.9 m -100.01 -37.88 8.81 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.61 -0.723 . . . . 7.91 110.171 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . 0.486 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 30.1 t80 -147.77 123.41 10.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.675 -0.693 . . . . 7.89 109.496 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' VAL . . . . . 0.536 HG21 ' HB2' ' B' ' 40' ' ' LEU . 14.5 t -120.46 138.87 49.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 120.884 0.374 . . . . 6.1 111.074 -179.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . 0.403 ' CG ' ' HE ' ' B' ' 28' ' ' ARG . 10.7 t70 -71.15 153.55 42.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.852 -0.613 . . . . 7.15 109.971 179.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 34.9 m170 -70.16 -10.82 60.0 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.806 0.299 . . . . 8.97 111.806 -178.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . 0.938 ' HG2' ' HB3' ' B' ' 8' ' ' GLN . 72.7 mtm180 -68.08 -11.45 59.07 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 111.995 0.368 . . . . 9.76 111.995 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 20.2 p -58.32 -38.76 77.77 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 111.861 0.319 . . . . 11.56 111.861 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 4.1 t -66.39 -31.96 55.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.338 -0.392 . . . . 13.64 111.072 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.63 -10.82 56.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.904 0.383 . . . . 12.9 111.458 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' THR . . . . . 0.455 ' HA ' HG22 ' B' ' 10' ' ' THR . 14.8 m -99.74 -59.83 1.64 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.068 -0.515 . . . . 12.13 111.978 -179.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' VAL . . . . . 0.726 HG12 HD21 ' B' ' 86' ' ' LEU . 3.3 m -116.57 -5.48 11.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 111.824 0.305 . . . . 13.87 111.824 -179.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.22 0.94 89.61 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.651 -0.785 . . . . 13.79 112.285 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' TYR . . . . . 0.45 ' HB2' HG23 ' B' ' 33' ' ' VAL . 2.4 m-85 -80.1 137.0 36.66 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.644 0.259 . . . . 15.38 111.054 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . 0.57 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 75.8 mm-40 -79.4 150.01 73.03 Favored Pre-proline 0 C--N 1.322 -0.63 0 N-CA-C 108.667 -0.864 . . . . 13.78 108.667 178.256 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' PRO . . . . . 0.528 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 51.6 Cg_exo -53.18 -38.5 81.26 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.613 2.208 . . . . 14.71 112.303 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -67.79 -22.2 65.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.965 -0.561 . . . . 17.54 111.408 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' GLU . . . . . 0.57 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 36.4 mt-10 -73.82 -23.12 59.62 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.655 0.264 . . . . 14.24 110.951 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.536 ' HB2' HG21 ' B' ' 25' ' ' VAL . 1.7 mm? -93.17 -34.92 13.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.895 0.379 . . . . 14.03 110.625 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 81.7 mt -58.31 119.07 6.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 13.62 111.259 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.33 5.01 76.55 Favored Glycine 0 N--CA 1.454 -0.163 0 C-N-CA 121.002 -0.618 . . . . 11.62 112.636 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.457 ' HA ' ' NZ ' ' B' ' 43' ' ' LYS . 0.5 OUTLIER -119.04 159.53 23.71 Favored 'General case' 0 C--N 1.321 -0.664 0 O-C-N 122.586 -0.361 . . . . 13.82 110.353 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' ASN . . . . . 0.672 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 12.5 m120 -95.46 140.15 30.73 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.35 -0.611 . . . . 10.16 109.35 178.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 20.8 tt -61.28 -24.63 33.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.305 0.574 . . . . 9.62 110.542 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' VAL . . . . . 0.41 HG12 ' HB3' ' B' ' 44' ' ' ASN . 9.0 p -71.84 -22.68 21.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.774 -0.648 . . . . 11.5 111.183 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' GLU . . . . . 0.672 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 40.5 mt-10 -67.07 -34.6 78.0 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.164 0.507 . . . . 11.89 110.481 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -104.08 24.67 11.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.729 -0.669 . . . . 13.6 110.433 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 49.0 t -109.19 148.78 30.38 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.832 -0.622 . . . . 10.81 110.41 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 8.1 t-160 -64.9 126.72 91.69 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.713 -0.676 . . . . 11.49 109.236 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -43.24 -48.8 7.81 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 123.534 2.823 . . . . 11.35 113.779 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -70.53 -7.91 47.34 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.135 0.42 . . . . 9.28 112.135 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' ASP . . . . . 0.637 ' HB3' ' HB2' ' B' ' 76' ' ' PHE . 16.5 m-20 -117.57 -1.17 11.71 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.951 0.405 . . . . 7.52 110.706 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -65.14 -49.22 70.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.969 -0.559 . . . . 6.57 111.659 -178.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -64.96 -34.86 79.43 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.504 -0.554 . . . . 6.58 109.504 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.3 tp -58.09 -42.92 86.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.961 -0.563 . . . . 4.6 109.777 178.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' LEU . . . . . 0.454 HD23 ' HA ' ' B' ' 57' ' ' LEU . 0.9 OUTLIER -69.16 -48.95 60.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.94 -0.573 . . . . 6.4 110.265 179.007 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' B' ' 58' ' ' ARG . 28.5 ttt180 -57.45 -46.32 83.75 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.875 -0.602 . . . . 8.18 111.244 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . 0.4 ' O ' ' HG3' ' B' ' 63' ' ' GLN . 12.7 t70 -61.0 -41.21 96.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.227 -0.442 . . . . 6.07 110.744 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 44.6 m -64.15 -35.54 81.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.479 . . . . 5.59 110.486 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 61' ' ' PHE . . . . . 0.508 ' O ' HG12 ' B' ' 64' ' ' VAL . 9.7 m-85 -64.18 -40.85 96.97 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.475 -0.565 . . . . 7.73 109.475 178.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -63.15 -38.83 92.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.96 -0.564 . . . . 6.89 109.969 178.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 63' ' ' GLN . . . . . 0.513 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 68.6 mt-30 -67.14 -47.62 70.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.688 -0.687 . . . . 9.4 111.132 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 64' ' ' VAL . . . . . 0.508 HG12 ' O ' ' B' ' 61' ' ' PHE . 4.1 p -62.24 -30.99 50.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-N 116.387 -0.37 . . . . 7.57 111.864 -178.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . 0.478 HG23 ' O ' ' B' ' 61' ' ' PHE . 70.9 t -68.75 -37.65 77.78 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 109.516 -0.55 . . . . 7.43 109.516 178.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -71.57 -32.72 68.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.786 -0.643 . . . . 10.21 110.165 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' B' ' 63' ' ' GLN . 94.0 mt -67.33 -54.13 23.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.854 -0.612 . . . . 7.2 110.365 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 23.5 mttt 63.26 113.37 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.439 -0.8 . . . . 7.58 112.008 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 77.26 19.81 76.23 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.798 -0.715 . . . . 5.57 112.17 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -126.01 153.5 44.3 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.937 -0.394 . . . . 5.43 109.937 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 71' ' ' VAL . . . . . 0.519 ' CG2' ' HB3' ' B' ' 91' ' ' SER . 3.3 p -110.96 116.37 52.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-O 121.299 0.571 . . . . 5.65 110.518 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 18.7 tp -107.95 116.56 32.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.701 -0.681 . . . . 4.51 110.306 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 73' ' ' SER . . . . . 0.547 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 7.6 m -90.36 115.7 27.75 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.175 -0.466 . . . . 6.35 110.995 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 p -113.83 126.96 71.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 116.096 -0.502 . . . . 4.34 110.107 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 24.7 ttt -94.83 113.79 25.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.167 0.508 . . . . 5.42 110.563 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.637 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 48.0 p90 -137.9 -174.58 3.82 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.63 -0.714 . . . . 3.54 109.397 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 77' ' ' ARG . . . . . . . . . . . . . 9.3 mtm180 -108.3 115.19 29.66 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.99 0.424 . . . . 6.8 110.11 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.552 ' HD2' HG11 ' B' ' 33' ' ' VAL . 28.0 t80 -100.52 148.46 24.77 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.656 -0.702 . . . . 5.79 110.282 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 79' ' ' ARG . . . . . 0.535 ' HA ' ' O ' ' B' ' 84' ' ' GLU . 20.2 ttp180 -85.77 133.47 33.99 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.142 -0.481 . . . . 11.08 110.725 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . 0.476 ' HA ' ' HB ' ' B' ' 33' ' ' VAL . 96.6 p -93.14 179.48 5.41 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.522 -0.547 . . . . 7.47 109.522 178.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 47.3 tptt -67.89 -14.76 63.22 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.607 0.718 . . . . 12.24 109.53 178.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 40.0 m-20 -89.02 2.52 53.89 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.151 -0.931 . . . . 9.25 109.685 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 66.49 25.08 10.22 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 115.305 -0.862 . . . . 8.3 111.522 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . 0.535 ' O ' ' HA ' ' B' ' 79' ' ' ARG . 1.9 pt-20 -104.29 167.15 9.94 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.228 -0.656 . . . . 6.78 109.228 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 85' ' ' TRP . . . . . 0.518 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 49.3 m95 -109.04 118.82 37.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.049 0.452 . . . . 7.89 110.69 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' LEU . . . . . 0.726 HD21 HG12 ' B' ' 33' ' ' VAL . 2.1 pp -116.02 150.38 37.33 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.004 -0.544 . . . . 6.97 109.986 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 87' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -72.73 122.19 21.09 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.871 -0.418 . . . . 8.55 109.871 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 15.0 tpp -128.35 126.6 41.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.135 -0.484 . . . . 4.46 110.96 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 30.3 ttp180 -100.19 87.58 3.49 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.292 -1.003 . . . . 6.87 108.292 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 90' ' ' THR . . . . . 0.457 HG23 ' HB3' ' B' ' 108' ' ' CYS . 28.0 m -80.66 112.87 18.42 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.672 -0.694 . . . . 6.18 112.309 -178.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 91' ' ' SER . . . . . 0.67 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 44.5 m -88.76 90.67 8.51 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.584 -0.734 . . . . 6.3 109.179 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 92' ' ' SER . . . . . 0.541 ' HA ' ' HA ' ' B' ' 108' ' ' CYS . 15.6 m -78.77 122.37 25.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.235 -0.438 . . . . 6.65 111.502 -178.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -118.17 121.37 40.33 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.284 -0.417 . . . . 6.45 110.562 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 94' ' ' THR . . . . . 0.437 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.6 OUTLIER -86.19 100.72 12.43 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.426 -0.352 . . . . 9.17 110.189 179.051 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -76.71 126.28 30.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.988 0.423 . . . . 8.33 111.084 -179.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -94.84 116.33 28.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.867 -0.606 . . . . 10.53 109.731 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 97' ' ' ASN . . . . . 0.402 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 51.5 t30 -65.46 126.75 92.11 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 109.544 -0.539 . . . . 8.43 109.544 179.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 98' ' ' PRO . . . . . 0.402 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 58.2 Cg_endo -71.29 42.72 0.46 Allowed 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 123.076 2.518 . . . . 9.16 113.693 -178.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -118.56 -61.2 1.69 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.407 -0.59 . . . . 11.34 109.407 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -135.14 22.47 3.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.638 -0.71 . . . . 7.75 109.868 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 4.3 t70 63.42 24.59 14.21 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.549 -0.75 . . . . 9.08 110.727 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -84.93 143.03 29.25 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.995 0.426 . . . . 7.71 110.462 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 67.1 mt -79.72 109.43 14.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.295 -0.412 . . . . 8.04 109.896 179.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -71.6 -41.93 68.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.422 -0.353 . . . . 8.81 110.647 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -169.89 168.63 8.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.296 -0.411 . . . . 7.4 109.911 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 22.1 mt -103.21 118.89 50.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.106 -0.497 . . . . 6.78 110.036 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 46.3 mt -88.62 93.19 4.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.74 -0.664 . . . . 6.31 109.912 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 108' ' ' CYS . . . . . 0.541 ' HA ' ' HA ' ' B' ' 92' ' ' SER . 67.1 m -87.75 116.79 26.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.183 -0.462 . . . . 5.31 111.295 -179.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . 0.67 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 1.2 m -88.69 83.38 6.73 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.149 -0.686 . . . . 5.48 109.149 178.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 110' ' ' ASN . . . . . 0.525 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 6.1 m-20 -67.24 103.08 1.16 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.707 -0.679 . . . . 6.9 111.14 -178.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 1.1 m -110.85 114.39 27.7 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.415 -0.357 . . . . 8.61 110.332 179.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 112' ' ' ASN . . . . . 0.579 HD22 HD13 ' B' ' 86' ' ' LEU . 4.6 t-20 -68.65 135.32 51.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.02 0.438 . . . . 11.84 110.772 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 9.4 t -104.29 -59.06 3.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.868 -0.606 . . . . 11.77 109.627 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 24.3 mtpt . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.207 -0.902 . . . . 12.68 109.945 -179.858 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.5 m . . . . . 0 N--CA 1.477 0.91 0 CA-C-O 120.75 0.309 . . . . 15.6 110.188 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.554 ' HA ' HG11 ' B' ' 71' ' ' VAL . 16.5 mt-30 -83.63 118.22 70.84 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.388 -0.369 . . . . 15.08 110.728 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -72.87 159.8 47.44 Favored 'Trans proline' 0 C--O 1.234 0.292 0 C-N-CA 122.859 2.373 . . . . 13.43 112.013 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.511 HG22 HG23 ' A' ' 32' ' ' THR . 0.1 OUTLIER -83.14 52.04 2.1 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.333 0.587 . . . . 11.09 111.106 179.92 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.667 ' HB2' HG23 ' A' ' 111' ' ' THR . 37.6 tt0 -147.09 136.93 23.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.446 -0.797 . . . . 10.59 108.964 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.84 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 42.5 p90 -151.75 154.16 35.72 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.071 0.463 . . . . 8.93 111.489 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.432 HD13 ' HA ' ' A' ' 13' ' ' ILE . 21.1 mm -88.64 127.31 41.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.061 -0.518 . . . . 8.66 110.842 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.901 ' HB3' ' HE2' ' A' ' 22' ' ' PHE . 1.4 m -110.23 97.39 6.88 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.831 -0.622 . . . . 6.11 110.791 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.434 ' HB2' ' O ' ' A' ' 24' ' ' PHE . 11.2 mtt180 -86.24 110.43 19.61 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.545 -0.539 . . . . 9.09 109.545 179.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 33.3 p80 -147.03 156.2 42.83 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.629 -0.259 . . . . 9.79 110.558 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.8 p-10 -76.62 -175.68 3.46 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.628 0.252 . . . . 12.69 110.926 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 26.9 pt -62.31 -25.44 37.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.273 0 N-CA-C 112.873 0.694 . . . . 13.58 112.873 -178.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -76.5 -30.53 57.25 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.214 0.53 . . . . 13.85 110.669 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 118.02 -6.38 15.4 Favored Glycine 0 N--CA 1.444 -0.814 0 N-CA-C 111.225 -0.75 . . . . 9.38 111.225 -179.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.444 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 34.6 mm -68.69 117.84 11.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 O-C-N 123.973 0.455 . . . . 10.74 109.791 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.901 ' HE2' ' HB3' ' A' ' 14' ' ' SER . 87.7 m-85 -73.2 132.92 43.78 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.083 0.468 . . . . 9.73 112.081 -178.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.02 -27.37 12.17 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.3 -0.864 . . . . 7.74 110.278 178.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.434 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 31.2 t80 -154.33 121.63 5.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.701 -0.681 . . . . 6.92 109.516 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.611 ' HB ' ' HB3' ' A' ' 37' ' ' PRO . 4.8 t -110.39 146.36 15.69 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 121.033 0.444 . . . . 6.02 111.236 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.84 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 6.0 t70 -68.5 170.89 8.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.546 -0.752 . . . . 7.31 110.459 179.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 28.1 m170 -94.27 -21.43 19.02 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.11 0.481 . . . . 11.67 110.077 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 77.0 mtm180 -78.92 0.1 28.73 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.866 -0.606 . . . . 11.91 111.89 -179.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 28.2 p -64.96 -33.51 76.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.972 0.415 . . . . 12.99 110.641 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.502 ' O ' ' HA2' ' A' ' 34' ' ' GLY . 2.9 t -69.59 -27.08 32.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.933 -0.576 . . . . 16.15 110.726 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.92 -24.38 26.62 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.105 0.479 . . . . 15.07 110.278 179.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.511 HG23 HG22 ' A' ' 10' ' ' THR . 25.2 m -85.01 -61.92 1.66 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.753 -0.658 . . . . 14.9 111.699 -179.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.612 HG23 ' H ' ' A' ' 35' ' ' TYR . 15.6 m -111.35 -15.22 10.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 111.941 0.349 . . . . 13.84 111.941 -179.245 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.502 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 89.39 0.11 80.19 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.423 -0.894 . . . . 13.85 112.325 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.612 ' H ' HG23 ' A' ' 33' ' ' VAL . 0.7 OUTLIER -83.46 135.04 34.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.653 0.263 . . . . 18.28 110.458 179.882 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.669 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 79.0 mm-40 -75.41 146.71 81.49 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 116.054 -0.521 . . . . 15.48 110.059 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.611 ' HB3' ' HB ' ' A' ' 25' ' ' VAL . 41.6 Cg_exo -57.12 -35.35 98.89 Favored 'Trans proline' 0 CA--C 1.527 0.166 0 C-N-CA 122.588 2.192 . . . . 11.63 112.185 -179.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.436 ' HA ' HD12 ' A' ' 41' ' ' LEU . 22.4 mp0 -69.25 -15.93 63.48 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.96 -0.564 . . . . 13.31 111.493 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.669 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 34.8 mt-10 -81.09 -32.48 33.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.786 0.327 . . . . 17.34 111.013 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.565 ' HB2' HG21 ' A' ' 25' ' ' VAL . 2.9 mm? -82.1 -24.66 35.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.121 -0.49 . . . . 13.25 110.915 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 89.7 mt -62.69 116.69 5.42 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.136 -0.484 . . . . 12.99 111.402 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.32 -4.26 85.34 Favored Glycine 0 N--CA 1.451 -0.339 0 CA-C-N 115.879 -0.601 . . . . 13.39 112.694 179.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.466 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 6.1 mmpt? -107.87 161.91 14.49 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.617 0.246 . . . . 16.87 110.457 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.762 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 15.1 m120 -95.66 139.02 32.51 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.544 -0.539 . . . . 12.5 109.544 179.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.58 HG13 ' HE1' ' A' ' 78' ' ' PHE . 9.1 tt -61.85 -30.37 48.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.016 0.436 . . . . 11.72 110.589 179.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.0 p -65.7 -22.03 30.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 116.183 -0.462 . . . . 12.89 111.254 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.762 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 41.1 mt-10 -73.83 -17.73 61.03 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.358 -0.383 . . . . 16.53 111.553 -179.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -117.97 24.53 10.96 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.17 0.51 . . . . 15.34 110.198 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 48.9 t -112.08 155.73 23.38 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.665 -0.698 . . . . 11.97 110.305 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.59 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 4.9 t-160 -56.92 122.33 51.93 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.842 -0.617 . . . . 14.67 109.408 178.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 99.2 Cg_exo -45.29 -49.06 10.7 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 123.456 2.77 . . . . 15.15 114.157 -178.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -75.77 0.93 16.22 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.291 0.478 . . . . 16.47 112.291 -179.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.59 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 26.4 m-20 -124.96 7.78 8.03 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.162 0.506 . . . . 13.16 110.159 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -66.35 -44.1 84.17 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.79 -0.641 . . . . 15.83 110.592 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.7 tp60 -62.58 -38.36 89.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.302 -0.408 . . . . 13.94 109.925 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 21.9 tp -57.48 -40.12 77.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.89 -0.595 . . . . 12.11 110.182 178.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.417 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.9 OUTLIER -69.59 -49.03 58.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.793 -0.639 . . . . 9.71 110.155 179.348 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.426 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 70.6 ttt180 -58.61 -48.61 80.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.986 -0.552 . . . . 11.06 111.392 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -56.56 -44.98 81.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.039 0.447 . . . . 9.71 110.807 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.3 m -70.28 -31.36 68.68 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.017 -0.538 . . . . 9.52 110.994 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.56 ' O ' HG12 ' A' ' 64' ' ' VAL . 1.4 m-30 -65.12 -49.99 67.79 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.048 -0.353 . . . . 11.4 110.048 178.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 58' ' ' ARG . 12.7 mm100 -64.8 -29.9 70.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.337 0.589 . . . . 10.04 109.572 179.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -66.27 -48.56 70.06 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.014 -0.993 . . . . 10.6 110.648 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.56 HG12 ' O ' ' A' ' 61' ' ' PHE . 4.3 p -64.74 -25.1 37.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-O 120.838 0.351 . . . . 10.62 110.87 -179.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.615 ' HA ' HG21 ' A' ' 94' ' ' THR . 93.1 t -70.61 -40.39 77.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 108.954 -0.758 . . . . 12.41 108.954 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -72.97 -29.24 62.91 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.546 -0.752 . . . . 16.25 109.963 178.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.737 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 88.7 mt -70.13 -48.17 58.6 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.981 -0.554 . . . . 12.66 109.94 178.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 32.8 mttt 59.61 99.47 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.571 -0.741 . . . . 14.83 112.607 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.03 -26.27 13.75 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.674 -0.774 . . . . 9.8 112.886 178.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.737 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 7.9 tp-100 -79.11 113.12 16.98 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.744 0.307 . . . . 9.59 110.251 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 3.0 p -66.64 116.6 6.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.804 -0.634 . . . . 8.1 110.805 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 64.8 tp -111.88 108.15 17.42 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.696 -0.684 . . . . 7.8 110.381 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.561 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 1.2 m -87.45 109.33 19.51 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.961 -0.563 . . . . 7.59 110.95 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 4.8 p -102.34 132.93 47.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.766 -0.457 . . . . 7.84 109.766 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . 0.479 ' HG2' ' HE3' ' A' ' 87' ' ' TRP . 23.1 ttt -102.41 122.0 43.44 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.904 0.383 . . . . 9.35 111.07 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.518 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 47.8 p90 -148.89 -174.7 4.7 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.204 -0.453 . . . . 9.66 110.075 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.49 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 31.2 mtm180 -110.61 120.65 43.09 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.12 0.486 . . . . 13.1 110.297 178.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.58 ' HE1' HG13 ' A' ' 45' ' ' ILE . 15.9 t80 -101.0 153.51 19.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.311 -0.859 . . . . 9.28 110.143 -179.309 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.53 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 42.7 ttt180 -90.01 124.0 34.38 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.13 -0.486 . . . . 10.87 110.636 179.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.42 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 59.5 p -85.84 -179.43 6.82 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.22 -0.446 . . . . 10.77 110.469 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -71.16 -14.45 62.28 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.516 0.674 . . . . 12.66 109.476 179.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.456 ' O ' ' HB2' ' A' ' 83' ' ' GLN . 87.9 m-20 -88.77 -1.79 58.26 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.435 -0.802 . . . . 14.42 109.74 179.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.456 ' HB2' ' O ' ' A' ' 82' ' ' ASN . 2.9 mp0 72.54 22.62 3.28 Favored 'General case' 0 N--CA 1.465 0.277 0 O-C-N 123.902 0.751 . . . . 12.69 110.748 -179.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.482 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.0 pt-20 -97.68 170.41 9.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.823 -0.626 . . . . 10.85 109.515 179.264 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.53 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 51.5 m95 -116.72 110.75 18.85 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.86 0.362 . . . . 11.2 110.529 -179.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.49 ' O ' ' HA ' ' A' ' 77' ' ' ARG . 0.5 OUTLIER -108.74 150.17 27.98 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.09 -0.504 . . . . 11.12 110.581 -179.821 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.904 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 72.0 m95 -82.35 117.12 22.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.972 0.415 . . . . 10.28 110.394 -179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.419 ' SD ' ' HB3' ' A' ' 110' ' ' ASN . 9.2 ttp -126.04 138.59 53.73 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.055 -0.52 . . . . 9.32 110.602 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 33.1 ttp-105 -103.81 107.38 18.23 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.896 -0.779 . . . . 10.66 108.896 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.629 HG23 ' HB3' ' A' ' 108' ' ' CYS . 24.7 m -92.61 105.37 17.54 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.742 -0.663 . . . . 9.37 112.426 -178.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.784 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 64.0 m -82.28 87.21 6.57 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.525 -0.917 . . . . 8.27 108.525 177.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.493 ' HA ' ' HA ' ' A' ' 108' ' ' CYS . 32.8 m -74.98 125.23 28.46 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.059 -0.519 . . . . 8.65 111.739 -178.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -123.41 109.52 13.97 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.593 -0.73 . . . . 11.56 109.58 179.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.615 HG21 ' HA ' ' A' ' 65' ' ' VAL . 0.2 OUTLIER -72.11 123.41 22.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.424 -0.353 . . . . 10.16 110.483 179.922 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . 0.442 ' O ' ' HA ' ' A' ' 103' ' ' ILE . 23.0 t80 -92.48 113.21 25.43 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.929 0.395 . . . . 12.25 111.09 -179.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -92.62 132.21 37.07 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.855 -0.611 . . . . 14.24 110.487 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -85.29 138.62 36.4 Favored Pre-proline 0 C--N 1.319 -0.751 0 N-CA-C 109.752 -0.462 . . . . 13.83 109.752 178.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -64.2 -11.45 27.84 Favored 'Trans proline' 0 CA--C 1.531 0.362 0 C-N-CA 122.753 2.302 . . . . 15.34 114.053 -179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -62.98 -74.7 0.09 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.741 0.305 . . . . 16.89 110.998 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.3 m -127.08 24.52 6.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.579 -0.282 . . . . 14.89 110.966 -179.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 28.7 t70 62.64 35.52 14.19 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 121.445 0.641 . . . . 14.77 110.615 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -94.1 139.47 30.94 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.406 -0.361 . . . . 12.95 110.382 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.442 ' HA ' ' O ' ' A' ' 95' ' ' PHE . 50.5 mt -83.32 106.97 14.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 116.209 -0.45 . . . . 11.11 109.967 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -73.2 -38.96 65.93 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.882 -0.327 . . . . 11.65 110.661 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.458 ' HE1' HG12 ' A' ' 107' ' ' ILE . 16.3 p90 -159.8 167.98 26.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.378 -0.374 . . . . 10.3 110.291 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 21.4 mt -110.18 120.63 61.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.969 -0.56 . . . . 10.29 110.138 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.606 HG21 HH22 ' B' ' 15' ' ' ARG . 15.7 mt -88.54 95.92 5.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.098 -0.501 . . . . 8.99 109.657 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.629 ' HB3' HG23 ' A' ' 90' ' ' THR . 96.3 m -91.07 116.32 28.7 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.086 -0.507 . . . . 9.83 111.936 -178.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.784 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 2.8 m -86.97 97.55 10.76 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.798 -0.815 . . . . 10.84 108.798 178.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.441 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 8.5 m-20 -86.14 104.82 16.07 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.143 -0.481 . . . . 11.26 111.908 -177.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.667 HG23 ' HB2' ' A' ' 11' ' ' GLU . 1.9 m -112.15 120.05 40.48 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.751 -0.462 . . . . 11.22 109.751 178.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . 0.482 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 2.6 t-20 -72.13 129.57 38.8 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.182 0.515 . . . . 12.78 111.072 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 3.5 t -103.45 -46.36 10.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.543 -0.753 . . . . 14.64 110.058 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.904 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 51.8 mtpt . . . . . 0 C--O 1.25 1.124 0 CA-C-O 118.44 -0.79 . . . . 16.02 109.74 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 56.1 m . . . . . 0 N--CA 1.479 1.02 0 CA-C-O 120.989 0.423 . . . . 7.49 110.373 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' GLN . . . . . 0.83 ' HG3' ' HA ' ' B' ' 28' ' ' ARG . 1.7 pm0 -108.15 150.6 40.67 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.234 -0.439 . . . . 7.12 109.887 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' B' ' 8' ' ' GLN . 11.3 Cg_exo -72.32 176.23 8.9 Favored 'Trans proline' 0 C--O 1.234 0.287 0 C-N-CA 122.842 2.361 . . . . 6.18 112.23 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . 0.746 HG22 ' HA ' ' B' ' 32' ' ' THR . 0.1 OUTLIER -82.59 50.5 1.67 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.272 -0.422 . . . . 5.81 111.684 -179.718 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.591 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -148.28 139.71 23.53 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.608 -0.515 . . . . 5.85 109.608 179.709 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' PHE . . . . . 0.738 ' HB3' ' HB2' ' B' ' 28' ' ' ARG . 33.8 p90 -155.28 153.37 30.49 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.018 0.437 . . . . 6.08 111.245 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.568 HG13 HG23 ' B' ' 107' ' ' ILE . 9.1 tt -88.03 113.26 24.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 115.651 -0.704 . . . . 5.57 110.47 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.443 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.7 OUTLIER -98.1 91.66 5.39 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.963 -0.562 . . . . 5.3 110.633 179.641 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . 0.62 ' HD3' ' HD2' ' B' ' 24' ' ' PHE . 8.7 mtp180 -82.56 111.22 18.35 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.884 -0.784 . . . . 8.97 108.884 179.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . 0.792 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 0.6 OUTLIER -146.51 172.5 13.46 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.367 -0.379 . . . . 8.31 111.425 -178.55 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -82.01 175.53 10.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.204 -0.453 . . . . 10.83 110.98 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 18.2 pt -58.82 -28.49 37.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 N-CA-C 113.039 0.755 . . . . 8.89 113.039 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -79.22 -10.37 59.8 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.882 0.372 . . . . 11.92 111.51 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 101.86 -8.35 55.99 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.452 -0.88 . . . . 8.57 112.987 179.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . 0.511 ' O ' ' HB2' ' B' ' 16' ' ' HIS . 24.8 mm -63.86 111.97 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 110.235 -0.283 . . . . 10.87 110.235 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . 0.792 ' HA ' ' HB3' ' B' ' 16' ' ' HIS . 97.4 m-85 -63.75 125.13 23.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.125 -0.489 . . . . 8.23 111.705 -179.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 3.1 m -98.87 -44.47 6.35 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.537 -0.756 . . . . 7.91 110.605 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . 0.62 ' HD2' ' HD3' ' B' ' 15' ' ' ARG . 78.5 t80 -147.35 123.0 10.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.878 -0.601 . . . . 7.89 109.983 179.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 25.7 t -120.72 131.58 72.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 116.177 -0.465 . . . . 6.1 110.361 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -69.77 158.94 34.49 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.748 -0.464 . . . . 7.15 109.748 179.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -78.2 51.03 0.96 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.29 -0.414 . . . . 8.97 111.717 -178.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . 0.83 ' HA ' ' HG3' ' B' ' 8' ' ' GLN . 23.5 mtm180 -125.37 -16.98 5.74 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.816 0.341 . . . . 9.76 110.583 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 22.7 p -61.71 -27.01 68.41 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.167 -0.469 . . . . 11.56 111.656 -179.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.46 HG13 HE22 ' B' ' 36' ' ' GLN . 34.0 t -59.75 -39.52 79.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.052 -0.522 . . . . 13.64 111.19 -179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.9 -15.4 39.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.332 -0.395 . . . . 12.9 111.285 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . 0.746 ' HA ' HG22 ' B' ' 10' ' ' THR . 4.1 m -88.59 -53.27 4.73 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.254 0.464 . . . . 12.13 112.254 -178.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' VAL . . . . . 0.624 HG11 ' HD2' ' B' ' 78' ' ' PHE . 3.5 m -124.93 -13.07 5.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 112.455 0.539 . . . . 13.87 112.455 -178.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 91.1 -21.0 36.56 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.4 -0.905 . . . . 13.79 112.06 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -67.08 128.88 38.02 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.92 -0.4 . . . . 15.38 109.92 179.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . 0.566 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 27.5 mm-40 -74.99 149.79 85.46 Favored Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 109.62 -0.511 . . . . 13.78 109.62 179.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.596 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 61.9 Cg_exo -51.4 -42.27 55.72 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.748 2.298 . . . . 14.71 112.503 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 24.6 mp0 -62.17 -27.92 69.3 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.907 -0.588 . . . . 17.54 111.577 -179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.566 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 30.6 mt-10 -72.84 -33.22 66.02 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.385 -0.371 . . . . 14.24 110.449 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.414 ' HB3' ' CG ' ' B' ' 22' ' ' PHE . 1.1 mm? -80.83 -30.89 35.69 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.104 -0.498 . . . . 14.03 111.106 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 79.6 mt -60.03 119.19 7.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.257 -0.429 . . . . 13.62 110.937 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.05 5.61 73.03 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.976 -0.63 . . . . 11.62 112.448 179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.492 ' O ' ' HA ' ' B' ' 21' ' ' ILE . 1.7 mmpt? -116.64 154.29 30.79 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.63 0.252 . . . . 13.82 110.747 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' ASN . . . . . 0.938 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 15.3 m120 -89.47 135.4 33.62 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.542 -0.54 . . . . 10.16 109.542 179.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . 0.45 HG21 ' HZ ' ' B' ' 61' ' ' PHE . 19.0 tt -61.96 -26.39 39.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 121.156 0.503 . . . . 9.62 110.634 179.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' VAL . . . . . 0.539 HG12 ' HB3' ' B' ' 44' ' ' ASN . 14.4 p -71.24 -22.1 22.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 CA-C-N 115.815 -0.629 . . . . 11.5 111.353 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . 0.938 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 35.9 mt-10 -69.69 -35.86 75.47 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.087 0.47 . . . . 11.89 110.652 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' PHE . . . . . 0.4 ' HE2' ' HB3' ' B' ' 43' ' ' LYS . 16.8 m-85 -97.11 8.78 43.79 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.883 -0.599 . . . . 13.6 109.915 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 44.4 t -93.27 147.79 22.6 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.861 -0.609 . . . . 10.81 110.858 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 5.4 t-160 -58.7 128.75 84.26 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.47 -0.787 . . . . 11.49 109.595 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -46.91 -51.09 9.77 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.186 2.591 . . . . 11.35 113.412 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -68.35 -5.26 17.84 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.311 0.486 . . . . 9.28 112.311 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -120.8 5.5 10.48 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.692 0.282 . . . . 7.52 111.185 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -64.07 -52.43 59.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.443 -0.344 . . . . 6.57 111.312 -179.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . 0.541 ' OE1' ' HD3' ' B' ' 58' ' ' ARG . 51.9 tp60 -63.95 -30.8 71.85 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.849 -0.426 . . . . 6.58 109.849 179.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.7 tp -59.17 -50.55 73.59 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.213 -0.662 . . . . 4.6 109.213 178.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.438 ' HA ' HD23 ' B' ' 57' ' ' LEU . 0.3 OUTLIER -67.56 -41.42 84.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.765 -0.652 . . . . 6.4 109.88 178.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . 0.541 ' HD3' ' OE1' ' B' ' 55' ' ' GLN . 38.5 ttt180 -55.21 -53.46 55.69 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.484 -0.78 . . . . 8.18 111.358 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . 0.458 ' O ' ' HG3' ' B' ' 63' ' ' GLN . 22.3 t70 -62.71 -37.81 87.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.468 -0.333 . . . . 6.07 110.453 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 50.9 m -61.67 -35.56 78.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.051 -0.522 . . . . 5.59 110.58 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' PHE . . . . . 0.544 ' O ' HG12 ' B' ' 64' ' ' VAL . 8.1 m-85 -63.59 -43.31 97.34 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 121.042 0.449 . . . . 7.73 109.901 178.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -68.47 -34.95 76.83 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.475 -0.565 . . . . 6.89 109.475 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' B' ' 59' ' ' ASP . 52.9 mt-30 -61.67 -47.53 84.94 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 115.702 -0.681 . . . . 9.4 110.968 179.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.544 HG12 ' O ' ' B' ' 61' ' ' PHE . 4.0 p -65.45 -29.82 48.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.402 -0.363 . . . . 7.57 111.216 -179.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . 0.505 HG23 ' O ' ' B' ' 61' ' ' PHE . 72.7 t -69.54 -37.51 74.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.202 0 N-CA-C 109.455 -0.572 . . . . 7.43 109.455 178.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -72.0 -27.28 62.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.663 -0.699 . . . . 10.21 110.081 178.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.484 ' HB3' ' HB2' ' B' ' 70' ' ' GLN . 52.2 mt -73.08 -61.69 1.73 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.646 -0.706 . . . . 7.2 110.531 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 37.0 mttt 65.52 108.99 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.298 0 O-C-N 123.876 0.735 . . . . 7.58 111.471 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 79.4 14.16 81.8 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.811 -0.709 . . . . 5.57 112.297 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.484 ' HB2' ' HB3' ' B' ' 67' ' ' LEU . 1.3 mp0 -125.19 157.37 36.65 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.237 -0.653 . . . . 5.43 109.237 179.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' VAL . . . . . 0.554 HG11 ' HA ' ' A' ' 8' ' ' GLN . 13.4 p -107.75 136.51 42.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-O 121.377 0.608 . . . . 5.65 111.121 -179.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 11.5 tp -123.25 111.44 16.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.696 -0.684 . . . . 4.51 109.938 179.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . 0.412 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 0.3 OUTLIER -89.13 117.02 27.82 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.125 -0.489 . . . . 6.35 111.038 179.97 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 7.6 p -116.18 135.87 54.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.753 -0.462 . . . . 4.34 109.753 179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 22.8 ttt -106.91 110.57 22.75 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.21 0.528 . . . . 5.42 111.142 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.411 ' HE2' ' HD1' ' B' ' 78' ' ' PHE . 45.1 p90 -137.07 -178.98 5.44 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.661 -0.7 . . . . 3.54 109.245 179.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' ARG . . . . . 0.583 ' HD2' ' HB3' ' B' ' 85' ' ' TRP . 37.9 mtm180 -106.5 122.2 45.81 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.08 0.467 . . . . 6.8 110.626 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.624 ' HD2' HG11 ' B' ' 33' ' ' VAL . 15.6 t80 -103.81 150.58 23.98 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.64 -0.709 . . . . 5.79 109.889 -179.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' ARG . . . . . 0.429 HH11 ' HD3' ' B' ' 79' ' ' ARG . 30.1 ttp180 -89.62 134.22 34.24 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.383 -0.371 . . . . 11.08 110.468 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 82.0 p -93.29 -176.38 4.12 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.217 -0.447 . . . . 7.47 110.087 179.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -70.73 -14.93 62.63 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.428 0.632 . . . . 12.24 109.391 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 68.5 m-20 -92.11 1.08 57.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.373 -0.83 . . . . 9.25 109.489 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' GLN . . . . . 0.425 ' HA ' ' HG2' ' B' ' 79' ' ' ARG . 2.3 mp0 67.03 22.79 9.9 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.167 -0.924 . . . . 8.3 111.241 -179.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -94.31 157.2 16.15 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.465 -0.569 . . . . 6.78 109.465 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . 0.583 ' HB3' ' HD2' ' B' ' 77' ' ' ARG . 81.6 m95 -99.38 116.45 31.57 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.832 0.348 . . . . 7.89 110.835 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 1.2 pp -119.32 145.83 45.81 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.174 -0.467 . . . . 6.97 110.027 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' TRP . . . . . 0.42 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 94.7 m95 -76.39 120.62 21.89 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.098 0.475 . . . . 8.55 110.777 -179.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 30.7 tpp -119.62 128.99 54.37 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.49 -0.777 . . . . 4.46 111.166 -178.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 20.4 ttp180 -99.2 82.54 2.72 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.714 -0.847 . . . . 6.87 108.714 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' THR . . . . . 0.493 HG23 ' HB3' ' B' ' 108' ' ' CYS . 47.8 m -75.66 114.87 14.74 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.534 -0.757 . . . . 6.18 111.712 -178.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' SER . . . . . 0.412 ' HA ' ' HA ' ' B' ' 73' ' ' SER . 1.4 m -96.73 95.93 8.25 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.565 -0.743 . . . . 6.3 109.119 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 10.3 m -84.07 123.4 30.0 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.185 -0.461 . . . . 6.65 112.028 -178.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . 0.46 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 65.0 t80 -120.48 122.58 40.97 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.92 -0.582 . . . . 6.45 109.555 179.123 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.79 113.89 21.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.708 0.29 . . . . 9.17 111.368 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . 0.491 ' HD1' ' HA ' ' B' ' 95' ' ' PHE . 0.0 OUTLIER -82.68 122.6 28.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 8.33 110.188 179.82 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -98.45 119.35 36.99 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.705 -0.679 . . . . 10.53 111.041 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 97' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -71.27 123.76 89.89 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 108.78 -0.822 . . . . 8.43 108.78 178.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.68 21.67 0.17 Allowed 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.023 2.482 . . . . 9.16 114.151 -178.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -94.69 -68.72 0.79 Allowed 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.564 -0.532 . . . . 11.34 109.564 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 6.1 m -129.66 20.1 5.61 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.088 -0.505 . . . . 7.75 110.252 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 33.7 t70 66.72 41.54 2.93 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.349 -0.842 . . . . 9.08 111.19 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -96.2 140.06 31.45 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.403 -0.362 . . . . 7.71 110.258 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 63.5 mt -79.63 108.83 13.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 N-CA-C 109.561 -0.533 . . . . 8.04 109.561 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.472 ' H ' ' HG2' ' B' ' 104' ' ' GLU . 6.4 pt-20 -72.94 -45.18 59.52 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.519 -0.309 . . . . 8.81 111.025 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -165.55 167.6 17.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.455 -0.339 . . . . 7.4 110.382 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 67.5 mt -106.0 121.85 58.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-N 115.959 -0.564 . . . . 6.78 110.155 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.568 HG23 HG13 ' B' ' 13' ' ' ILE . 83.4 mt -87.75 100.03 9.58 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.893 -0.594 . . . . 6.31 109.734 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' CYS . . . . . 0.493 ' HB3' HG23 ' B' ' 90' ' ' THR . 68.1 m -100.6 97.91 8.54 Favored 'General case' 0 C--N 1.318 -0.803 0 C-N-CA 120.823 -0.351 . . . . 5.31 111.522 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 46.3 m -75.36 99.29 4.08 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.121 -0.696 . . . . 5.48 109.121 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' ASN . . . . . 0.553 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.3 m-20 -80.46 109.27 14.81 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.654 -0.703 . . . . 6.9 110.899 -178.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . 0.472 HG23 ' HB2' ' B' ' 11' ' ' GLU . 0.3 OUTLIER -113.09 110.88 21.19 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.114 -0.494 . . . . 8.61 110.127 179.245 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' ASN . . . . . 0.722 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 10.8 t-20 -70.59 129.77 40.07 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.992 0.425 . . . . 11.84 110.754 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 38.8 t -106.36 -51.16 7.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.838 -0.619 . . . . 11.77 110.057 179.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . 0.42 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 34.4 mtpt . . . . . 0 C--O 1.246 0.889 0 CA-C-O 118.567 -0.73 . . . . 12.68 110.217 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 75.5 m . . . . . 0 N--CA 1.474 0.76 0 CA-C-O 120.79 0.329 . . . . 15.6 110.407 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 43.2 mm-40 -101.29 104.25 31.95 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.839 -0.619 . . . . 15.08 109.831 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.89 153.85 67.86 Favored 'Trans proline' 0 C--O 1.234 0.298 0 C-N-CA 122.742 2.295 . . . . 13.43 112.751 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.812 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.2 OUTLIER -79.53 52.49 1.4 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.347 0.594 . . . . 11.09 111.079 179.609 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.496 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 40.8 tt0 -152.37 123.75 7.72 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.417 -0.81 . . . . 10.59 108.825 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.784 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 44.7 p90 -139.79 151.11 45.5 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.066 0.46 . . . . 8.93 111.732 -178.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.596 HG13 HD13 ' B' ' 107' ' ' ILE . 0.0 OUTLIER -111.32 129.31 66.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.784 -0.644 . . . . 8.66 109.866 -179.715 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.5 m -134.32 139.29 45.57 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.316 0.579 . . . . 6.11 112.35 -179.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.6 ' HD2' ' HD2' ' A' ' 24' ' ' PHE . 6.5 mtt85 -89.54 133.37 34.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.161 -0.927 . . . . 9.09 108.978 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.516 ' CB ' ' HA ' ' A' ' 22' ' ' PHE . 33.5 p80 -154.89 158.69 39.71 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.183 0.516 . . . . 9.79 111.751 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -65.85 155.7 35.53 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.992 -1.004 . . . . 12.69 109.278 178.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 18.4 pt -53.87 -31.02 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 N-CA-C 112.406 0.521 . . . . 13.58 112.406 -179.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -75.12 -16.59 60.53 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.821 0.343 . . . . 13.85 111.83 -179.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 120.58 -19.48 9.08 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.308 -0.949 . . . . 9.38 113.553 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.487 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 30.6 mm -57.5 110.36 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 116.829 0.314 . . . . 10.74 110.978 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.516 ' HA ' ' CB ' ' A' ' 16' ' ' HIS . 82.3 m-85 -71.95 138.78 48.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.973 0.416 . . . . 9.73 111.457 -179.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 2.6 m -115.4 -36.9 4.17 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.756 -0.656 . . . . 7.74 110.891 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.6 ' HD2' ' HD2' ' A' ' 15' ' ' ARG . 18.6 t80 -139.48 110.7 6.95 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.409 -0.589 . . . . 6.92 109.409 179.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.546 HG21 ' HB2' ' A' ' 40' ' ' LEU . 7.3 t -97.61 150.24 4.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 116.447 -0.342 . . . . 6.02 110.776 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.784 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 7.8 t70 -69.35 172.58 6.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.704 -0.68 . . . . 7.31 110.087 179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -91.02 -21.38 21.3 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.124 0.488 . . . . 11.67 109.828 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 76.5 mtm180 -84.41 5.69 26.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.633 -0.712 . . . . 11.91 111.943 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 4.5 p -59.94 -42.92 95.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.323 0.582 . . . . 12.99 110.441 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.672 HG13 HE22 ' A' ' 36' ' ' GLN . 4.1 t -66.45 -28.88 44.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.522 -0.763 . . . . 16.15 111.04 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.24 -6.12 59.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.16 -0.473 . . . . 15.07 111.684 -179.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.487 ' HA ' HG22 ' A' ' 10' ' ' THR . 18.4 m -109.71 -56.99 2.24 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.724 0.297 . . . . 14.9 111.334 -179.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.593 HG23 ' H ' ' A' ' 35' ' ' TYR . 11.1 m -113.17 -19.61 6.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.704 0.288 . . . . 13.84 111.702 -179.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 94.51 -8.84 71.73 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.462 -0.875 . . . . 13.85 112.359 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.593 ' H ' HG23 ' A' ' 33' ' ' VAL . 4.6 m-85 -74.01 136.76 43.17 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.377 -0.231 . . . . 18.28 110.377 179.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.672 HE22 HG13 ' A' ' 30' ' ' VAL . 33.3 mm-40 -80.7 153.54 73.16 Favored Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 109.139 -0.689 . . . . 15.48 109.139 178.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.572 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 52.6 Cg_exo -53.56 -38.97 84.18 Favored 'Trans proline' 0 CA--C 1.529 0.237 0 C-N-CA 122.568 2.179 . . . . 11.63 112.712 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -71.11 -14.63 62.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.219 -0.446 . . . . 13.31 111.665 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.529 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 34.2 mt-10 -82.31 -20.65 36.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.911 0.386 . . . . 17.34 110.366 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.546 ' HB2' HG21 ' A' ' 25' ' ' VAL . 3.3 mm? -95.51 -24.11 16.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.771 -0.649 . . . . 13.25 110.495 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 82.5 mt -61.0 122.79 15.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.849 -0.614 . . . . 12.99 111.028 -179.579 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.405 ' HA2' HG23 ' A' ' 21' ' ' ILE . . . 76.31 9.18 85.82 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.879 -0.677 . . . . 13.39 112.586 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.738 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 9.0 mmpt? -114.1 153.39 29.57 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.908 0.385 . . . . 16.87 110.667 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.512 ' HB3' HG12 ' A' ' 46' ' ' VAL . 16.2 m120 -94.84 138.22 32.9 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.85 -0.613 . . . . 12.5 109.48 179.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.7 tt -61.14 -23.23 29.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.146 0.498 . . . . 11.72 110.856 179.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.512 HG12 ' HB3' ' A' ' 44' ' ' ASN . 11.5 p -70.8 -20.71 22.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 116.075 -0.511 . . . . 12.89 111.432 -179.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.405 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 45.3 mt-10 -72.75 -39.24 66.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.194 0.521 . . . . 16.53 110.461 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -97.36 19.44 13.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.679 -0.691 . . . . 15.34 110.396 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.506 ' SG ' HD12 ' A' ' 57' ' ' LEU . 49.8 t -104.56 149.5 25.45 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.837 -0.619 . . . . 11.97 110.513 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.406 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 4.9 t-160 -58.16 125.31 74.26 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.507 -0.77 . . . . 14.67 109.335 178.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.454 ' HA ' ' CD ' ' A' ' 54' ' ' GLN . 88.5 Cg_exo -48.89 -38.99 39.52 Favored 'Trans proline' 0 CA--C 1.533 0.452 0 C-N-CA 123.089 2.526 . . . . 15.15 113.823 -178.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -81.46 0.67 36.69 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.939 0.348 . . . . 16.47 111.939 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.406 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 36.7 m-20 -125.76 2.31 7.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.831 0.348 . . . . 13.16 110.978 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.454 ' CD ' ' HA ' ' A' ' 51' ' ' PRO . 85.5 mt-30 -61.99 -39.76 93.32 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.134 -0.484 . . . . 15.83 111.059 -179.395 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 56.8 tp60 -66.74 -44.38 81.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.262 -0.426 . . . . 13.94 110.211 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 41.2 tp -59.96 -41.97 93.08 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.218 -0.446 . . . . 12.11 110.37 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.506 HD12 ' SG ' ' A' ' 49' ' ' CYS . 0.2 OUTLIER -62.56 -53.09 59.91 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.003 -0.544 . . . . 9.71 110.114 179.307 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.427 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 52.7 ttt180 -59.77 -45.52 92.01 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.581 -0.736 . . . . 11.06 111.412 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -58.58 -46.72 86.32 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.335 -0.393 . . . . 9.71 111.025 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.3 m -66.46 -33.65 76.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.201 -0.454 . . . . 9.52 110.812 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.466 ' O ' HG12 ' A' ' 64' ' ' VAL . 1.8 m-30 -64.44 -30.08 71.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.065 0.459 . . . . 11.4 109.924 178.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 58' ' ' ARG . 18.7 mm100 -79.13 -31.72 44.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.855 -0.611 . . . . 10.04 110.236 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -66.49 -42.49 87.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.876 -0.602 . . . . 10.6 110.972 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.466 HG12 ' O ' ' A' ' 61' ' ' PHE . 9.5 p -64.01 -25.98 39.43 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-O 121.011 0.434 . . . . 10.62 110.399 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.499 ' HA ' HG21 ' A' ' 94' ' ' THR . 82.7 t -72.58 -38.31 58.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 109.382 -0.599 . . . . 12.41 109.382 178.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 41.5 mtpt -68.98 -40.81 78.57 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.717 -0.674 . . . . 16.25 110.022 179.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.703 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 86.9 mt -62.57 -49.63 74.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.669 -0.696 . . . . 12.66 110.75 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 62.5 mttt 66.01 99.37 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.815 -0.63 . . . . 14.83 112.394 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 82.16 14.37 77.04 Favored Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 121.029 -0.605 . . . . 9.8 113.356 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.703 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 7.3 tp-100 -119.74 123.62 44.19 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.551 -0.537 . . . . 9.59 109.551 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 6.8 p -71.35 126.32 31.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.297 0.57 . . . . 8.1 111.128 -179.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 22.4 tp -115.73 123.97 49.64 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.811 -0.631 . . . . 7.8 109.706 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -92.54 116.7 29.23 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.085 -0.507 . . . . 7.59 111.262 -179.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.1 p -119.56 122.8 69.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 121.106 0.479 . . . . 7.84 110.253 179.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 11.7 ttt -100.36 127.31 46.71 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.259 -0.428 . . . . 9.35 111.172 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.502 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 45.3 p90 -154.18 -179.57 8.03 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.915 -0.584 . . . . 9.66 109.755 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.474 ' HD2' ' HB3' ' A' ' 85' ' ' TRP . 11.4 mtm180 -100.86 119.83 39.25 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.907 0.384 . . . . 13.1 109.987 179.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.502 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 21.5 t80 -104.9 150.59 24.74 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.883 -0.598 . . . . 9.28 110.475 -179.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.54 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 28.3 ttp180 -86.5 133.08 33.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.323 -0.399 . . . . 10.87 110.573 179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 59.8 p -93.11 -175.36 3.83 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.675 -0.491 . . . . 10.77 109.675 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.464 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 37.6 tptt -72.24 -14.65 61.83 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.25 0.548 . . . . 12.66 109.704 178.514 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -95.48 5.23 52.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.729 -0.668 . . . . 14.42 109.768 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 68.08 23.58 8.02 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.162 -0.926 . . . . 12.69 112.018 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.5 pt-20 -94.01 161.88 14.11 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.789 -0.449 . . . . 10.85 109.789 179.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.54 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 81.7 m95 -107.16 106.16 16.5 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.816 0.341 . . . . 11.2 110.288 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.486 HD21 HG12 ' A' ' 33' ' ' VAL . 1.6 pp -105.78 148.67 27.23 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.198 -0.455 . . . . 11.12 110.866 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.673 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 96.3 m95 -81.29 117.18 21.57 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.294 -0.412 . . . . 10.28 110.068 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.484 ' SD ' ' HB3' ' A' ' 110' ' ' ASN . 3.7 ttp -130.61 141.52 50.44 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.255 -0.43 . . . . 9.32 111.193 -179.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 8.5 ttp180 -103.25 100.49 10.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.717 -0.674 . . . . 10.66 109.323 178.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.525 HG23 ' HB3' ' A' ' 108' ' ' CYS . 37.7 m -82.91 113.93 20.85 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.247 0.546 . . . . 9.37 111.511 -179.289 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.673 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 0.7 OUTLIER -91.78 91.15 7.81 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.688 -0.856 . . . . 8.27 108.688 178.382 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.1 m -82.0 131.07 35.24 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.075 -0.511 . . . . 8.65 111.896 -178.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -127.12 121.6 31.88 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.771 -0.65 . . . . 11.56 109.812 179.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.499 HG21 ' HA ' ' A' ' 65' ' ' VAL . 0.0 OUTLIER -76.31 111.28 11.58 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.911 0.386 . . . . 10.16 110.695 179.717 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -81.44 100.73 9.44 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.136 0.493 . . . . 12.25 110.049 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.518 ' HG2' HG12 ' A' ' 103' ' ' ILE . 37.4 mt-30 -90.2 152.99 20.84 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.732 -0.667 . . . . 14.24 111.31 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.446 ' OD1' ' HB2' ' A' ' 99' ' ' TYR . 15.6 t-20 -102.82 130.35 23.99 Favored Pre-proline 0 C--N 1.32 -0.684 0 CA-C-N 115.427 -0.806 . . . . 13.83 109.046 179.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -76.22 54.62 4.29 Favored 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.576 2.184 . . . . 15.34 112.876 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.446 ' HB2' ' OD1' ' A' ' 97' ' ' ASN . 4.3 t80 -125.95 -55.25 1.49 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.172 -0.467 . . . . 16.89 110.348 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -138.41 22.2 2.75 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.983 -0.553 . . . . 14.89 109.746 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 10.0 t70 63.29 33.23 14.24 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.59 -0.732 . . . . 14.77 110.021 -179.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -90.45 162.58 15.01 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.92 -0.582 . . . . 12.95 110.289 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.518 HG12 ' HG2' ' A' ' 96' ' ' GLN . 43.8 mt -110.58 119.85 60.22 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.78 -0.452 . . . . 11.11 109.78 179.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.81 -40.76 27.85 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.856 -0.338 . . . . 11.65 110.737 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 14.4 p90 -169.16 -178.18 3.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.258 -0.428 . . . . 10.3 110.209 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 73.0 mt -121.59 127.16 75.53 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 120.876 0.37 . . . . 10.29 110.88 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.564 HG22 HG22 ' A' ' 13' ' ' ILE . 19.3 mt -99.62 122.3 51.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 108.623 -0.88 . . . . 8.99 108.623 178.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.525 ' HB3' HG23 ' A' ' 90' ' ' THR . 81.5 m -110.26 132.21 54.37 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.255 0.55 . . . . 9.83 112.452 -178.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.707 HG21 HG13 ' B' ' 13' ' ' ILE . 12.8 m -100.27 95.8 7.03 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.776 -1.102 . . . . 10.84 108.447 178.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.496 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 6.7 m-20 -81.93 105.85 13.38 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.093 -0.503 . . . . 11.26 111.839 -178.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 1.7 m -102.3 112.56 25.31 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.802 -0.635 . . . . 11.22 110.085 178.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . 0.812 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 10.0 t-20 -72.47 125.28 27.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.905 0.383 . . . . 12.78 110.55 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 46.4 t -102.98 -50.21 9.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.158 -0.474 . . . . 14.64 109.897 179.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.673 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 89.8 mttt . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.283 -0.865 . . . . 16.02 110.09 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 80.3 m . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 109.939 -0.393 . . . . 7.49 109.939 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' GLN . . . . . 0.411 ' HA ' ' HD3' ' B' ' 9' ' ' PRO . 18.5 mm-40 -133.74 146.32 59.76 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 116.646 -0.252 . . . . 7.12 110.537 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . 0.706 ' HD2' ' HG2' ' B' ' 28' ' ' ARG . 18.1 Cg_exo -67.54 167.57 20.46 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 123.025 2.483 . . . . 6.18 112.104 179.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.97 57.89 3.62 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.479 0.656 . . . . 5.81 111.136 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.508 ' HA ' ' O ' ' B' ' 110' ' ' ASN . 0.0 OUTLIER -166.62 148.62 6.46 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.315 -0.995 . . . . 5.85 108.315 179.043 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 47.7 p90 -156.21 162.74 40.14 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.422 0.629 . . . . 6.08 112.06 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.707 HG13 HG21 ' A' ' 109' ' ' THR . 27.0 mm -96.33 117.35 40.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 114.912 -1.04 . . . . 5.57 110.409 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.468 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.9 OUTLIER -106.86 101.86 11.26 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.005 -0.543 . . . . 5.3 110.831 -179.769 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . 0.562 ' HD3' ' HB3' ' B' ' 24' ' ' PHE . 26.8 mtp85 -91.94 108.01 19.62 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.175 -0.676 . . . . 8.97 109.175 179.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . 0.553 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 31.9 p80 -139.55 164.46 29.84 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.345 -0.389 . . . . 8.31 110.897 -178.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 10.8 p-10 -75.71 -177.83 3.92 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.408 -0.36 . . . . 10.83 110.48 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 33.9 pt -65.64 -28.17 43.45 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 N-CA-C 112.455 0.539 . . . . 8.89 112.455 -178.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -72.69 -32.75 66.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.724 0.297 . . . . 11.92 110.934 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 125.58 -11.4 7.52 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.578 -0.82 . . . . 8.57 112.267 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . 0.406 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 39.3 mm -62.12 112.64 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.775 0.321 . . . . 10.87 110.388 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . 0.553 ' HA ' ' HB3' ' B' ' 16' ' ' HIS . 97.2 m-85 -69.81 129.68 40.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.97 -0.559 . . . . 8.23 111.279 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.85 -33.91 7.82 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.82 -0.627 . . . . 7.91 110.607 179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . 0.562 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 37.8 t80 -152.05 124.69 8.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.33 -0.396 . . . . 7.89 110.483 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 4.8 t -125.88 141.11 46.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 116.077 -0.511 . . . . 6.1 109.973 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -73.68 159.81 32.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.899 0.381 . . . . 7.15 110.222 179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 35.8 m80 -69.28 -10.34 57.39 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.088 -0.506 . . . . 8.97 112.036 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . 0.706 ' HG2' ' HD2' ' B' ' 9' ' ' PRO . 60.9 mtm180 -67.1 -20.06 65.73 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.429 0.529 . . . . 9.76 112.429 -179.202 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 32.1 p -59.75 -29.86 68.45 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.144 0.424 . . . . 11.56 112.144 -178.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.733 HG13 HE22 ' B' ' 36' ' ' GLN . 21.8 t -61.94 -37.57 78.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.216 -0.447 . . . . 13.64 112.059 -178.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -91.85 -12.65 33.05 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.019 0.438 . . . . 12.9 111.181 -179.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 16.3 m -88.14 -64.71 1.1 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.252 -0.431 . . . . 12.13 111.368 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' VAL . . . . . 0.538 HG23 ' H ' ' B' ' 35' ' ' TYR . 6.9 m -108.64 -13.0 10.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.755 0.312 . . . . 13.87 111.614 -179.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' GLY . . . . . 0.435 ' HA2' ' O ' ' B' ' 30' ' ' VAL . . . 89.65 -12.68 66.32 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.573 -0.822 . . . . 13.79 112.003 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' TYR . . . . . 0.538 ' H ' HG23 ' B' ' 33' ' ' VAL . 14.9 m-85 -73.12 141.2 47.49 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.682 0.277 . . . . 15.38 110.632 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . 0.733 HE22 HG13 ' B' ' 30' ' ' VAL . 34.7 mm-40 -84.64 148.65 52.31 Favored Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 108.902 -0.777 . . . . 13.78 108.902 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.715 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 52.4 Cg_exo -52.63 -39.78 74.91 Favored 'Trans proline' 0 N--CA 1.465 -0.153 0 C-N-CA 122.301 2.001 . . . . 14.71 111.986 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 26.0 mp0 -65.9 -20.24 66.15 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.938 -0.573 . . . . 17.54 112.22 -179.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.557 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 42.6 mt-10 -79.15 -39.35 33.74 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.892 -0.41 . . . . 14.24 109.892 179.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -73.41 -34.21 65.38 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.905 -0.589 . . . . 14.03 111.207 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.715 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 56.6 mt -59.18 114.66 2.73 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.96 0.409 . . . . 13.62 111.304 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 98.32 -7.72 62.11 Favored Glycine 0 N--CA 1.45 -0.422 0 CA-C-N 115.825 -0.625 . . . . 11.62 112.44 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.442 ' HE2' ' HA ' ' B' ' 43' ' ' LYS . 1.4 mmpt? -108.47 166.68 10.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.74 0.305 . . . . 13.82 110.925 -179.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' ASN . . . . . 0.805 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 12.8 m120 -103.04 149.33 24.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.801 -0.636 . . . . 10.16 109.959 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 18.9 tt -71.48 -27.34 28.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.957 0.408 . . . . 9.62 110.819 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 9.9 p -71.76 -20.53 20.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 CA-C-O 120.986 0.422 . . . . 11.5 111.413 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . 0.805 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 41.8 mt-10 -70.52 -34.47 72.34 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.254 -0.43 . . . . 11.89 110.98 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -103.08 26.3 8.39 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.109 -0.496 . . . . 13.6 110.147 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 49.8 t -107.57 152.55 24.11 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.001 -0.545 . . . . 10.81 111.082 -179.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' HIS . . . . . 0.456 ' HB2' ' HB2' ' B' ' 77' ' ' ARG . 8.8 t-80 -63.92 130.29 94.38 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 115.401 -0.818 . . . . 11.49 109.538 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' PRO . . . . . 0.436 ' HD2' ' CD2' ' B' ' 50' ' ' HIS . 85.9 Cg_exo -43.53 -51.18 6.28 Favored 'Trans proline' 0 C--N 1.346 0.417 0 C-N-CA 123.606 2.871 . . . . 11.35 114.438 -179.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -72.98 -3.91 28.96 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.375 0.509 . . . . 9.28 112.375 -179.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . 0.603 ' HB3' ' HB2' ' B' ' 76' ' ' PHE . 14.8 m-20 -118.35 3.86 11.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.986 0.422 . . . . 7.52 110.692 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -68.2 -48.23 65.79 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.919 -0.582 . . . . 6.57 111.524 -178.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 49.7 tp60 -65.23 -33.49 76.12 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.858 -0.423 . . . . 6.58 109.858 179.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 22.0 tp -61.38 -39.23 89.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.963 -0.562 . . . . 4.6 109.993 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 1.1 mt -66.39 -47.47 73.23 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.786 -0.643 . . . . 6.4 110.272 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 58.2 ttt180 -61.95 -46.09 90.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.807 -0.633 . . . . 8.18 111.036 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -58.95 -45.68 89.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.167 -0.47 . . . . 6.07 111.056 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 15.7 m -66.84 -36.4 82.26 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.247 -0.433 . . . . 5.59 110.869 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' PHE . . . . . 0.633 ' O ' HG12 ' B' ' 64' ' ' VAL . 1.7 m-30 -64.64 -42.8 95.21 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.732 0.301 . . . . 7.73 110.539 179.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -65.17 -28.75 69.62 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.079 0.466 . . . . 6.89 110.405 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -76.82 -37.86 54.94 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.993 -0.549 . . . . 9.4 111.021 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.727 ' HA ' HD12 ' B' ' 67' ' ' LEU . 2.8 p -65.74 -27.46 41.42 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 CA-C-O 120.775 0.321 . . . . 7.57 110.474 -179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . 0.444 HG23 ' O ' ' B' ' 61' ' ' PHE . 92.4 t -69.77 -34.77 62.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 121.327 0.585 . . . . 7.43 109.605 178.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -80.27 -18.26 49.86 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.636 -0.711 . . . . 10.21 110.439 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.85 ' HB3' ' HB2' ' B' ' 70' ' ' GLN . 64.8 mt -74.3 -46.92 38.08 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.862 -0.608 . . . . 7.2 110.572 179.326 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 86.2 mttt 56.6 88.46 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.85 0.719 . . . . 7.58 112.538 179.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.55 -4.0 63.73 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.431 -0.89 . . . . 5.57 112.533 178.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.85 ' HB2' ' HB3' ' B' ' 67' ' ' LEU . 2.3 mp0 -104.68 141.53 36.28 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 110.164 -0.31 . . . . 5.43 110.164 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' VAL . . . . . 0.832 ' HB ' ' HD1' ' B' ' 93' ' ' PHE . 7.1 p -92.94 132.33 37.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.151 0.5 . . . . 5.65 111.054 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 14.9 tp -119.98 111.73 18.28 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.917 -0.583 . . . . 4.51 109.435 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . 0.611 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.2 p -91.24 110.29 21.57 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.208 -0.451 . . . . 6.35 110.926 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.1 p -103.83 128.69 56.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-N 116.122 -0.49 . . . . 4.34 110.107 179.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 28.4 ttt -99.29 109.11 21.78 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.366 -0.379 . . . . 5.42 110.292 -179.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.603 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 51.5 p90 -138.6 -173.64 3.61 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.058 -0.519 . . . . 3.54 110.121 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' ARG . . . . . 0.456 ' HB2' ' HB2' ' B' ' 50' ' ' HIS . 26.3 mtt180 -106.64 115.61 30.49 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.754 0.311 . . . . 6.8 110.32 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -102.64 149.45 24.43 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.035 -0.53 . . . . 5.79 110.021 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' ARG . . . . . 0.584 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 17.5 ttp180 -88.88 133.06 34.41 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.925 0.393 . . . . 11.08 110.618 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . 0.492 ' OG ' ' HG2' ' B' ' 84' ' ' GLU . 91.0 p -94.58 -176.33 3.88 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.683 -0.488 . . . . 7.47 109.683 178.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . 0.444 ' HA ' ' HD2' ' B' ' 81' ' ' LYS . 40.2 tptt -68.26 -16.22 63.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.27 0.557 . . . . 12.24 110.014 179.077 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -88.11 -0.54 57.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.678 -0.692 . . . . 9.25 109.884 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 65.93 28.78 10.54 Favored 'General case' 0 C--N 1.334 -0.076 0 CA-C-N 115.551 -0.75 . . . . 8.3 110.795 -179.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . 0.492 ' HG2' ' OG ' ' B' ' 80' ' ' SER . 12.2 pt-20 -106.53 163.72 12.65 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.031 -0.729 . . . . 6.78 109.031 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . 0.584 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 49.9 m95 -105.15 127.76 53.06 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.135 0.493 . . . . 7.89 111.426 -179.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -129.26 151.3 50.06 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.792 -0.64 . . . . 6.97 109.814 179.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 87' ' ' TRP . . . . . 0.541 ' HD1' ' HB2' ' B' ' 114' ' ' LYS . 98.8 m95 -75.65 111.57 11.12 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.358 0.599 . . . . 8.55 110.511 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 88' ' ' MET . . . . . 0.414 ' SD ' ' HB3' ' B' ' 110' ' ' ASN . 47.0 tpp -116.0 123.44 48.01 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.248 -0.887 . . . . 4.46 110.722 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 33.3 ttp180 -97.76 83.27 3.16 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.592 -0.892 . . . . 6.87 108.592 178.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 90' ' ' THR . . . . . 0.636 HG23 ' HB3' ' B' ' 108' ' ' CYS . 36.2 m -72.06 109.45 5.87 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.418 -0.81 . . . . 6.18 111.231 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 91' ' ' SER . . . . . 0.67 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 1.9 m -90.38 87.89 6.97 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.697 -0.683 . . . . 6.3 109.339 179.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' B' ' 108' ' ' CYS . 9.2 m -75.39 120.46 20.87 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.84 -0.618 . . . . 6.65 111.517 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . 0.832 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 55.8 t80 -116.88 124.22 48.94 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.943 -0.572 . . . . 6.45 110.085 179.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . 0.522 HG22 HG21 ' B' ' 103' ' ' ILE . 0.3 OUTLIER -83.69 103.26 12.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.881 0.372 . . . . 9.17 110.691 179.76 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . 0.483 ' CZ ' ' HB ' ' A' ' 13' ' ' ILE . 0.0 OUTLIER -74.62 117.17 16.15 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.156 -0.474 . . . . 8.33 110.52 -179.647 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -83.25 116.91 22.62 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.751 -0.659 . . . . 10.53 110.584 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 97' ' ' ASN . . . . . 0.484 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 62.7 t30 -80.74 127.84 73.83 Favored Pre-proline 0 C--N 1.322 -0.625 0 N-CA-C 109.251 -0.648 . . . . 8.43 109.251 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . 0.484 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 23.5 Cg_endo -62.32 73.27 0.11 Allowed 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.257 2.638 . . . . 9.16 113.054 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . 0.424 ' HB3' ' H ' ' B' ' 100' ' ' SER . 3.6 m-85 -147.4 -137.58 0.09 Allowed 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.818 -0.808 . . . . 11.34 108.818 179.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 100' ' ' SER . . . . . 0.424 ' H ' ' HB3' ' B' ' 99' ' ' TYR . 0.3 OUTLIER -80.54 49.3 1.15 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.665 0.269 . . . . 7.75 110.968 179.437 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 38.8 t70 50.53 77.0 0.13 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.719 -0.673 . . . . 9.08 111.101 -179.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . 0.463 ' HG3' ' HB3' ' B' ' 97' ' ' ASN . 3.4 pt-20 -133.43 151.46 51.8 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.946 0.403 . . . . 7.71 111.459 -179.143 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' ILE . . . . . 0.522 HG21 HG22 ' B' ' 94' ' ' THR . 40.2 mt -94.9 98.3 7.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.638 -0.71 . . . . 8.04 109.146 178.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -58.45 -47.8 82.8 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.985 -0.552 . . . . 8.81 110.723 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' TYR . . . . . 0.445 ' HE1' HD11 ' B' ' 107' ' ' ILE . 8.1 p90 -161.31 163.49 30.78 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.104 -0.498 . . . . 7.4 110.133 179.567 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 62.6 mt -105.16 114.32 44.42 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.896 -0.593 . . . . 6.78 109.686 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.688 HG23 HG23 ' B' ' 13' ' ' ILE . 88.1 mt -86.87 104.21 13.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.008 -0.542 . . . . 6.31 109.697 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' CYS . . . . . 0.636 ' HB3' HG23 ' B' ' 90' ' ' THR . 75.6 m -94.43 108.49 20.41 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.967 -0.561 . . . . 5.31 111.632 -179.179 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . 0.67 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 27.5 m -82.47 90.94 6.79 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.94 -0.763 . . . . 5.48 108.94 177.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' ASN . . . . . 0.508 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.0 m-20 -72.24 106.86 4.59 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.836 -0.62 . . . . 6.9 111.363 -178.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 1.4 m -108.72 109.03 20.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.308 -0.406 . . . . 8.61 110.189 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -70.95 127.07 31.35 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.987 0.422 . . . . 11.84 110.586 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . 0.4 HG12 ' HG3' ' B' ' 114' ' ' LYS . 35.2 t -100.23 -55.46 5.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.769 -0.65 . . . . 11.77 109.751 179.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . 0.541 ' HB2' ' HD1' ' B' ' 87' ' ' TRP . 45.4 mtpt . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.516 -0.754 . . . . 12.68 109.703 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 80.0 m . . . . . 0 N--CA 1.477 0.925 0 N-CA-C 110.328 -0.249 . . . . 15.6 110.328 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 53.7 mm-40 -101.39 106.95 48.64 Favored Pre-proline 0 C--N 1.324 -0.517 0 N-CA-C 109.689 -0.485 . . . . 15.08 109.689 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.65 164.85 34.41 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.769 2.312 . . . . 13.43 112.556 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.716 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.2 OUTLIER -82.89 52.0 2.05 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.154 0.502 . . . . 11.09 110.975 179.737 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.44 ' HB2' HG23 ' A' ' 111' ' ' THR . 40.2 tt0 -156.41 129.97 8.26 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.782 -0.645 . . . . 10.59 109.479 -179.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.945 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 39.4 p90 -144.83 145.11 31.48 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.937 0.399 . . . . 8.93 111.425 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.51 HG23 HG23 ' A' ' 107' ' ' ILE . 2.5 mp -93.57 117.93 38.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 N-CA-C 109.795 -0.446 . . . . 8.66 109.795 179.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 52.8 p -105.16 121.97 44.94 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.233 0.539 . . . . 6.11 111.057 -179.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.9 mtp180 -97.85 102.9 14.77 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.303 -0.999 . . . . 9.09 108.303 178.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.407 ' O ' ' HB2' ' A' ' 105' ' ' TYR . 31.8 p80 -130.46 153.85 48.36 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.511 -0.313 . . . . 9.79 110.931 -178.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -69.18 173.98 5.1 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.475 -0.329 . . . . 12.69 110.236 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.0 pt -58.83 -29.51 40.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 112.802 0.667 . . . . 13.58 112.802 -178.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -73.94 -21.38 60.06 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.887 0.375 . . . . 13.85 111.465 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 112.12 -0.93 26.92 Favored Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 120.436 -0.888 . . . . 9.38 112.509 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.423 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 40.2 mm -72.98 118.45 18.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 109.679 -0.489 . . . . 10.74 109.679 179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.418 ' CG ' ' HB3' ' A' ' 40' ' ' LEU . 86.9 m-85 -69.41 113.63 6.89 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.183 -0.462 . . . . 9.73 111.507 -179.362 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.83 -35.95 23.85 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.355 0.598 . . . . 7.74 109.659 178.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -152.78 125.85 8.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.312 -0.858 . . . . 6.92 108.985 179.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.62 HG21 ' HB2' ' A' ' 40' ' ' LEU . 2.5 t -110.35 147.88 14.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.953 0.406 . . . . 6.02 111.414 -178.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.945 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 6.4 t70 -68.81 168.9 12.46 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.874 -0.603 . . . . 7.31 109.764 179.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 60.5 m170 -95.34 -11.96 26.9 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 120.995 0.426 . . . . 11.67 110.574 -179.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 85.6 mtm180 -82.0 -5.94 58.74 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.895 -0.593 . . . . 11.91 111.947 -179.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.6 p -60.88 -27.37 68.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.867 0.365 . . . . 12.99 111.163 -179.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.437 HG13 HE22 ' A' ' 36' ' ' GLN . 15.0 t -65.14 -32.67 59.27 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.045 -0.525 . . . . 16.15 110.823 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.52 -27.19 21.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.182 -0.463 . . . . 15.07 110.787 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.559 ' HA ' HG22 ' A' ' 10' ' ' THR . 4.0 m -76.63 -55.37 5.57 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.114 -0.494 . . . . 14.9 111.376 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.568 HG11 ' HD2' ' A' ' 78' ' ' PHE . 2.7 m -120.13 -30.07 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 111.871 0.322 . . . . 13.84 111.871 -179.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.436 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 110.48 -23.57 19.91 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.307 -0.949 . . . . 13.85 112.015 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -65.58 135.86 55.62 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.743 0.306 . . . . 18.28 110.529 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.638 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 48.7 mm-40 -77.3 150.41 80.11 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 109.16 -0.682 . . . . 15.48 109.16 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.567 ' HB3' ' HB ' ' A' ' 25' ' ' VAL . 53.6 Cg_exo -52.36 -40.0 71.82 Favored 'Trans proline' 0 CA--C 1.528 0.202 0 C-N-CA 122.443 2.095 . . . . 11.63 112.05 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.579 ' HA ' HD12 ' A' ' 41' ' ' LEU . 25.7 mp0 -65.6 -20.34 66.27 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.621 -0.718 . . . . 13.31 111.612 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.638 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 29.3 mt-10 -78.74 -28.14 44.89 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 110.146 -0.316 . . . . 17.34 110.146 179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.62 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.7 mm? -86.58 -26.9 24.23 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.879 -0.601 . . . . 13.25 110.791 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.579 HD12 ' HA ' ' A' ' 38' ' ' GLN . 96.7 mt -60.43 119.34 7.82 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.106 -0.497 . . . . 12.99 110.824 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 86.9 3.8 82.8 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 121.01 -0.614 . . . . 13.39 112.41 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.517 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 8.3 mmpt? -113.95 161.2 17.95 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.224 -0.287 . . . . 16.87 110.224 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.653 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 16.8 m120 -98.06 136.37 38.41 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.669 -0.493 . . . . 12.5 109.669 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.493 HD13 ' HZ ' ' A' ' 61' ' ' PHE . 13.8 tt -58.8 -27.55 35.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.106 0.479 . . . . 11.72 110.992 179.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.2 p -71.21 -18.68 20.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.051 -0.522 . . . . 12.89 111.56 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.653 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.0 mt-10 -71.14 -34.63 71.21 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.035 0.445 . . . . 16.53 110.901 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.414 ' HB2' ' CZ ' ' A' ' 78' ' ' PHE . 30.7 m-85 -100.45 24.14 9.31 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.903 -0.59 . . . . 15.34 110.471 -179.147 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 46.0 t -110.57 150.19 29.3 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.059 -0.519 . . . . 11.97 110.063 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.527 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 6.8 t-160 -58.33 125.17 74.51 Favored Pre-proline 0 C--N 1.328 -0.339 0 N-CA-C 109.133 -0.691 . . . . 14.67 109.133 178.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_exo -45.63 -46.36 15.04 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 123.189 2.592 . . . . 15.15 113.679 -179.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -75.82 0.03 19.48 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.121 0.415 . . . . 16.47 112.121 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.527 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 9.5 m-20 -122.03 -0.17 9.54 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.963 0.411 . . . . 13.16 110.246 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 83.6 mt-30 -63.9 -45.47 89.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.791 -0.64 . . . . 15.83 111.557 -179.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 33.7 tp60 -66.46 -37.0 84.18 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.433 -0.58 . . . . 13.94 109.433 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.8 tp -59.48 -42.1 91.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.727 -0.67 . . . . 12.11 109.445 178.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -67.73 -51.24 51.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.521 -0.763 . . . . 9.71 110.327 179.159 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -57.29 -47.22 82.03 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.767 -0.651 . . . . 11.06 111.606 -179.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.478 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 31.3 t70 -58.96 -45.89 89.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.32 -0.4 . . . . 9.71 110.983 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.4 m -65.87 -33.27 75.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.966 -0.561 . . . . 9.52 111.022 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.593 ' O ' HG12 ' A' ' 64' ' ' VAL . 1.9 m-85 -62.88 -39.47 94.54 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.051 0.453 . . . . 11.4 110.163 179.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -70.22 -32.0 69.68 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.043 -0.526 . . . . 10.04 110.092 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.645 ' HA ' ' HD3' ' A' ' 66' ' ' LYS . 65.7 mt-30 -66.08 -39.02 89.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.95 -0.568 . . . . 10.6 111.219 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.593 HG12 ' O ' ' A' ' 61' ' ' PHE . 2.3 p -68.14 -25.38 31.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.854 0.359 . . . . 10.62 110.687 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.427 ' O ' ' HG3' ' A' ' 68' ' ' LYS . 86.6 t -73.6 -34.82 42.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 N-CA-C 109.157 -0.683 . . . . 12.41 109.157 178.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.645 ' HD3' ' HA ' ' A' ' 63' ' ' GLN . 45.3 mtpt -72.23 -38.99 68.81 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.518 -0.765 . . . . 16.25 109.634 178.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 65.9 mt -66.01 -53.49 38.03 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.296 -0.865 . . . . 12.66 111.034 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' A' ' 65' ' ' VAL . 62.7 mttt 60.33 91.46 0.05 Allowed 'General case' 0 N--CA 1.466 0.326 0 O-C-N 123.658 0.599 . . . . 14.83 112.38 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 105.74 -13.6 46.15 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.726 -0.75 . . . . 9.8 112.804 179.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.521 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 6.3 tp-100 -96.67 126.25 41.7 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.269 -0.271 . . . . 9.59 110.269 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.448 ' HA ' ' O ' ' A' ' 92' ' ' SER . 2.4 p -80.75 112.93 19.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-O 121.333 0.587 . . . . 8.1 110.587 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 39.3 tp -104.29 117.33 33.94 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.616 -0.72 . . . . 7.8 110.398 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -87.76 106.93 18.39 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.863 -0.608 . . . . 7.59 111.193 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.472 HG13 ' HB ' ' A' ' 90' ' ' THR . 2.6 p -101.28 122.98 54.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.112 0.482 . . . . 7.84 109.867 179.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 23.6 ttt -99.78 118.42 36.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.243 -0.435 . . . . 9.35 110.954 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.588 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 45.4 p90 -145.9 -171.65 3.75 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.663 -0.699 . . . . 9.66 109.279 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.454 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 44.9 mtm180 -110.55 120.12 41.39 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.055 0.455 . . . . 13.1 110.398 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.588 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 12.7 t80 -102.25 151.88 21.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.316 -0.856 . . . . 9.28 110.15 -179.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.492 ' HA ' ' O ' ' A' ' 84' ' ' GLU . 37.9 ttp180 -88.61 128.16 35.58 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.171 -0.468 . . . . 10.87 110.471 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.474 ' HA ' ' HB ' ' A' ' 33' ' ' VAL . 54.9 p -88.47 -176.25 5.25 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.299 -0.41 . . . . 10.77 110.025 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.4 tptt -72.33 -14.23 61.69 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.104 -0.702 . . . . 12.66 109.104 178.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -90.74 1.38 56.92 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.316 -0.856 . . . . 14.42 109.489 178.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 67.82 22.91 8.63 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.207 -0.906 . . . . 12.69 111.316 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.492 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.5 pt-20 -96.1 167.95 10.9 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.755 -0.461 . . . . 10.85 109.755 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.464 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 77.2 m95 -108.92 108.31 19.02 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.582 -0.281 . . . . 11.2 110.562 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.529 HD21 HG12 ' A' ' 33' ' ' VAL . 2.6 pp -110.0 151.09 27.58 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.488 -0.324 . . . . 11.12 110.365 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.538 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 96.9 m95 -77.59 119.66 21.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.039 0.447 . . . . 10.28 110.527 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.437 ' SD ' ' HB3' ' A' ' 110' ' ' ASN . 30.5 tpp -119.2 135.41 54.69 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.776 -0.647 . . . . 9.32 111.063 -178.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 2.7 ttp180 -104.72 81.69 1.8 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.65 -0.87 . . . . 10.66 108.65 178.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.598 HG23 ' HB3' ' A' ' 108' ' ' CYS . 28.7 m -71.38 109.51 5.41 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.689 -0.687 . . . . 9.37 111.963 -178.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.487 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 0.7 OUTLIER -87.51 93.42 9.41 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.431 -0.804 . . . . 8.27 108.982 178.697 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.448 ' O ' ' HA ' ' A' ' 71' ' ' VAL . 16.4 m -81.91 124.02 29.35 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.04 0.448 . . . . 8.65 111.452 -178.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -125.63 125.06 42.52 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.746 -0.661 . . . . 11.56 109.93 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.69 129.51 37.22 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.297 -0.411 . . . . 10.16 111.474 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -114.04 109.97 19.29 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.376 -0.375 . . . . 12.25 110.079 179.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.41 ' HG3' HG12 ' A' ' 103' ' ' ILE . 0.0 OUTLIER -112.55 152.91 28.29 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.997 0.427 . . . . 14.24 110.966 -179.694 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -92.37 145.87 31.43 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 109.15 -0.685 . . . . 13.83 109.15 178.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.15 28.61 0.36 Allowed 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 122.65 2.233 . . . . 15.34 113.288 -179.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 49.0 m-85 -98.7 -64.69 1.01 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.145 0.498 . . . . 16.89 110.001 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.449 ' HB2' ' HG3' ' A' ' 102' ' ' GLU . 49.5 m -133.24 17.98 4.06 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.686 -0.688 . . . . 14.89 109.648 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 23.9 t70 63.62 34.16 12.62 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.272 -0.877 . . . . 14.77 109.811 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.449 ' HG3' ' HB2' ' A' ' 100' ' ' SER . 0.1 OUTLIER -80.3 130.22 35.04 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.181 -0.918 . . . . 12.95 110.154 -179.796 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.41 HG12 ' HG3' ' A' ' 96' ' ' GLN . 36.7 mt -81.15 106.74 12.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 109.872 -0.418 . . . . 11.11 109.872 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -70.58 -43.81 68.65 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.728 0.299 . . . . 11.65 110.328 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.407 ' HB2' ' O ' ' A' ' 16' ' ' HIS . 31.6 p90 -165.5 172.4 12.14 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.211 -0.449 . . . . 10.3 110.295 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 52.1 mt -110.86 122.76 65.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-N 116.106 -0.497 . . . . 10.29 110.529 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.51 HG23 HG23 ' A' ' 13' ' ' ILE . 87.4 mt -84.56 110.72 19.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 109.311 -0.626 . . . . 8.99 109.311 179.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.598 ' HB3' HG23 ' A' ' 90' ' ' THR . 64.5 m -110.79 109.37 19.56 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.143 0.497 . . . . 9.83 111.505 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.722 HG21 HG13 ' B' ' 13' ' ' ILE . 22.5 m -83.78 100.01 10.65 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.823 -0.806 . . . . 10.84 108.823 178.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.437 ' HB3' ' SD ' ' A' ' 88' ' ' MET . 6.0 m-20 -84.68 101.57 12.28 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.989 -0.55 . . . . 11.26 111.549 -178.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.44 HG23 ' HB2' ' A' ' 11' ' ' GLU . 2.5 m -103.87 121.1 42.37 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.98 -0.555 . . . . 11.22 109.791 178.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . 0.716 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 6.3 t-20 -75.87 125.26 28.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.939 0.4 . . . . 12.78 110.826 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 61.7 t -98.55 -49.47 11.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-N 115.728 -0.669 . . . . 14.64 109.929 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.538 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 52.1 mtpt . . . . . 0 C--O 1.252 1.194 0 CA-C-O 118.483 -0.77 . . . . 16.02 110.388 -179.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 72.4 m . . . . . 0 N--CA 1.477 0.88 0 CA-C-O 120.871 0.367 . . . . 7.49 110.23 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' GLN . . . . . 0.55 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 71.6 mm-40 -95.08 142.3 24.42 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 116.026 -0.534 . . . . 7.12 110.997 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . 0.451 ' HD3' ' HA ' ' B' ' 8' ' ' GLN . 10.8 Cg_exo -72.87 171.99 16.29 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 123.099 2.533 . . . . 6.18 111.757 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.91 56.48 3.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.312 0.577 . . . . 5.81 111.082 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.66 ' HA ' ' O ' ' B' ' 110' ' ' ASN . 0.0 OUTLIER -162.85 141.74 8.69 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.399 -0.963 . . . . 5.85 108.399 179.722 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -152.47 165.73 34.17 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.334 0.588 . . . . 6.08 112.274 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.722 HG13 HG21 ' A' ' 109' ' ' THR . 9.1 mm -90.57 118.07 35.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 114.857 -1.065 . . . . 5.57 110.329 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.665 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.7 OUTLIER -106.31 94.49 5.18 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.773 -0.649 . . . . 5.3 110.293 179.639 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . 0.562 ' HG2' HG12 ' B' ' 107' ' ' ILE . 55.8 mtp180 -87.58 101.89 14.06 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.273 -0.64 . . . . 8.97 109.273 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' B' ' 105' ' ' TYR . 35.0 p80 -132.21 162.07 31.85 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.132 -0.486 . . . . 8.31 110.551 -179.064 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -83.17 177.91 8.34 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.517 -0.311 . . . . 10.83 110.291 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 26.6 pt -60.91 -20.88 22.8 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 113.24 0.83 . . . . 8.89 113.24 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -83.69 -14.42 51.8 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.196 0.522 . . . . 11.92 110.601 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 104.14 -6.34 46.72 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.486 -0.864 . . . . 8.57 111.901 -179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . 0.542 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 26.9 mm -70.03 117.21 12.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 110.021 -0.362 . . . . 10.87 110.021 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . 0.665 ' HE1' ' HB3' ' B' ' 14' ' ' SER . 97.0 m-85 -73.4 133.07 43.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.201 0.524 . . . . 8.23 111.829 -179.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -103.89 -35.3 8.2 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.479 -0.782 . . . . 7.91 110.018 178.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -148.04 129.55 14.91 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.794 -0.639 . . . . 7.89 110.246 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.568 HG21 ' HB2' ' B' ' 40' ' ' LEU . 12.4 t -124.23 126.49 72.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 109.479 -0.563 . . . . 6.1 109.479 179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -67.76 156.06 37.86 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.975 0.416 . . . . 7.15 110.765 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 29.6 m170 -62.59 -19.21 63.51 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.842 -0.617 . . . . 8.97 112.2 -178.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . 0.55 ' HG2' ' HB3' ' B' ' 8' ' ' GLN . 70.3 mtm180 -64.78 -16.73 63.42 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.839 0.311 . . . . 9.76 111.839 -179.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 30.3 p -60.77 -32.62 71.93 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 120.872 0.368 . . . . 11.56 111.099 -179.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.653 HG13 HE22 ' B' ' 36' ' ' GLN . 18.1 t -64.51 -36.22 76.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 13.64 111.076 -179.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.49 -19.13 31.67 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 120.985 0.422 . . . . 12.9 110.811 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 20.1 m -84.52 -57.93 2.94 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.152 -0.476 . . . . 12.13 111.889 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' VAL . . . . . 0.464 HG11 ' HD2' ' B' ' 78' ' ' PHE . 6.2 m -122.24 -5.01 8.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 N-CA-C 112.373 0.509 . . . . 13.87 112.373 -178.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 86.86 -18.21 36.51 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.471 -0.871 . . . . 13.79 112.962 179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 7.2 m-85 -67.05 136.96 56.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.734 0.302 . . . . 15.38 110.919 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . 0.653 HE22 HG13 ' B' ' 30' ' ' VAL . 33.5 mm-40 -80.57 151.65 71.83 Favored Pre-proline 0 C--N 1.323 -0.586 0 N-CA-C 109.144 -0.687 . . . . 13.78 109.144 178.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.516 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 74.5 Cg_exo -50.61 -44.31 40.95 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.845 2.363 . . . . 14.71 112.864 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -65.11 -24.95 67.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.079 -0.509 . . . . 17.54 112.164 -179.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.633 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 30.6 mt-10 -69.19 -25.82 64.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.805 0.336 . . . . 14.24 111.061 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.568 ' HB2' HG21 ' B' ' 25' ' ' VAL . 2.2 mm? -94.84 -21.27 18.8 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.226 -0.443 . . . . 14.03 110.873 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 52.5 mt -61.87 119.24 8.42 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.217 -0.447 . . . . 13.62 110.826 -179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 82.14 10.07 84.29 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.862 -0.685 . . . . 11.62 112.511 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.687 ' HE2' ' HA ' ' B' ' 43' ' ' LYS . 8.7 mmpt? -117.0 156.24 27.82 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 110.153 -0.314 . . . . 13.82 110.153 179.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' ASN . . . . . 0.731 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 13.5 m120 -93.29 135.93 34.04 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.153 -0.476 . . . . 10.16 109.91 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . 0.42 ' HB ' ' CZ ' ' B' ' 22' ' ' PHE . 15.4 tt -59.71 -26.27 34.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.285 0.564 . . . . 9.62 110.847 178.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' VAL . . . . . 0.401 HG12 ' HB3' ' B' ' 44' ' ' ASN . 9.8 p -71.17 -22.05 22.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.844 -0.616 . . . . 11.5 111.243 -179.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . 0.731 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 44.2 mt-10 -70.63 -30.04 66.58 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.968 0.413 . . . . 11.89 110.668 -179.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' PHE . . . . . 0.416 ' HE1' ' HB3' ' B' ' 43' ' ' LYS . 40.4 m-85 -105.37 21.06 17.82 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.933 -0.576 . . . . 13.6 110.447 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 53.4 t -104.52 151.98 22.93 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 116.004 -0.544 . . . . 10.81 110.411 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' HIS . . . . . 0.432 ' CD2' ' HD2' ' B' ' 51' ' ' PRO . 10.4 t-80 -61.61 126.54 87.03 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.817 -0.629 . . . . 11.49 109.542 178.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' PRO . . . . . 0.432 ' HD2' ' CD2' ' B' ' 50' ' ' HIS . 76.0 Cg_exo -42.55 -50.32 5.85 Favored 'Trans proline' 0 CA--C 1.533 0.439 0 C-N-CA 123.62 2.88 . . . . 11.35 114.143 -179.354 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -75.98 2.98 11.19 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.649 0.611 . . . . 9.28 112.649 -179.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -126.27 3.26 7.07 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.997 0.427 . . . . 7.52 110.841 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 54.9 mt-30 -67.6 -37.55 82.73 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.822 -0.626 . . . . 6.57 110.692 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 47.8 tp60 -65.86 -40.84 92.07 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.994 -0.743 . . . . 6.58 108.994 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.513 HD23 ' HB3' ' B' ' 76' ' ' PHE . 32.1 tp -57.2 -45.07 84.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.132 -0.94 . . . . 4.6 110.713 178.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.453 ' HA ' HD23 ' B' ' 57' ' ' LEU . 1.0 OUTLIER -61.02 -50.33 73.78 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.053 -0.521 . . . . 6.4 110.739 179.645 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 55.3 ttt180 -59.82 -45.39 92.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.783 -0.644 . . . . 8.18 110.925 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -62.0 -45.32 94.14 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.926 -0.579 . . . . 6.07 110.985 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 23.4 m -63.33 -37.85 88.88 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.219 -0.446 . . . . 5.59 110.684 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' PHE . . . . . 0.504 ' O ' HG12 ' B' ' 64' ' ' VAL . 4.3 m-30 -65.08 -41.0 95.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.379 -0.373 . . . . 7.73 110.411 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -63.9 -39.02 93.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.98 0.419 . . . . 6.89 110.273 179.184 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.438 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 39.2 mt-30 -69.11 -40.48 78.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.976 -0.556 . . . . 9.4 111.792 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.504 HG12 ' O ' ' B' ' 61' ' ' PHE . 4.0 p -67.19 -25.39 33.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-O 120.767 0.317 . . . . 7.57 111.11 -179.278 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . 0.508 ' HA ' HG21 ' B' ' 94' ' ' THR . 51.7 t -69.21 -35.83 69.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 109.263 -0.643 . . . . 7.43 109.263 178.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -70.48 -36.06 73.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.511 -0.768 . . . . 10.21 110.093 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' B' ' 63' ' ' GLN . 69.8 mt -65.56 -43.86 88.52 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.119 -0.697 . . . . 7.2 109.119 178.654 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 65.9 tttt 47.29 90.57 0.02 OUTLIER 'General case' 0 C--O 1.235 0.298 0 CA-C-N 114.801 -1.09 . . . . 7.58 112.837 178.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 108.6 1.59 32.67 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.552 -0.832 . . . . 5.57 112.334 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -114.94 165.34 12.97 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.986 -0.376 . . . . 5.43 109.986 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' VAL . . . . . . . . . . . . . 6.6 t -108.14 127.13 64.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 121.067 0.461 . . . . 5.65 111.118 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 42.0 tp -119.52 103.11 9.14 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.567 -0.742 . . . . 4.51 109.062 178.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . 0.575 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.3 p -86.64 112.59 21.76 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.046 -0.525 . . . . 6.35 111.228 -179.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 p -107.04 127.16 62.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 115.704 -0.68 . . . . 4.34 109.927 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 28.7 ttt -100.54 110.33 22.49 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.08 0.467 . . . . 5.42 110.815 -179.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.513 ' HB3' HD23 ' B' ' 56' ' ' LEU . 51.9 p90 -137.14 -173.16 3.38 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.729 -0.669 . . . . 3.54 109.368 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' ARG . . . . . 0.483 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 50.6 mtm180 -105.15 119.48 39.16 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.148 0.499 . . . . 6.8 110.507 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.464 ' HD2' HG11 ' B' ' 33' ' ' VAL . 16.8 t80 -102.49 148.84 25.03 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.2 -0.909 . . . . 5.79 110.339 -179.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' ARG . . . . . 0.649 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 3.6 ttp180 -90.06 124.27 34.64 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.205 -0.452 . . . . 11.08 110.185 179.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . 0.499 ' HB3' HD21 ' B' ' 86' ' ' LEU . 95.0 p -91.52 -175.23 4.14 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.579 -0.526 . . . . 7.47 109.579 178.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -65.16 -16.6 63.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.113 0.482 . . . . 12.24 110.479 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -89.23 -0.22 57.29 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.13 -0.486 . . . . 9.25 110.458 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 69.16 12.59 8.53 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.7 -0.682 . . . . 8.3 111.678 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 15.3 pt-20 -89.96 154.85 19.53 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.937 -0.394 . . . . 6.78 109.937 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . 0.649 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 57.2 m95 -97.86 108.48 21.2 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.31 -0.405 . . . . 7.89 111.371 -178.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.499 HD21 ' HB3' ' B' ' 80' ' ' SER . 1.9 pp -109.31 147.52 32.54 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.071 -0.513 . . . . 6.97 110.176 179.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 87' ' ' TRP . . . . . 0.764 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 87.3 m95 -77.74 118.66 20.31 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.106 0.479 . . . . 8.55 110.231 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 7.3 tpp -123.32 135.07 54.02 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.589 -0.732 . . . . 4.46 111.319 -178.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 37.5 ttp180 -96.17 89.55 5.18 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.633 -0.877 . . . . 6.87 108.633 178.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 90' ' ' THR . . . . . 0.687 HG23 ' HB3' ' B' ' 108' ' ' CYS . 27.4 m -78.29 104.01 8.6 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.867 -0.606 . . . . 6.18 111.111 -179.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 91' ' ' SER . . . . . 0.588 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 1.8 m -85.63 91.0 8.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.875 -0.602 . . . . 6.3 109.707 179.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 9.3 m -78.53 122.22 25.6 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.814 -0.63 . . . . 6.65 111.58 -178.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -122.09 121.74 37.64 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.095 -0.502 . . . . 6.45 110.082 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . 0.508 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.1 OUTLIER -82.23 110.25 17.25 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.449 -0.341 . . . . 9.17 110.395 179.483 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.68 126.51 30.99 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.138 0.494 . . . . 8.33 110.552 -179.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -96.26 119.05 34.03 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.555 -0.748 . . . . 10.53 110.446 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 97' ' ' ASN . . . . . 0.418 ' HB3' ' OE1' ' B' ' 102' ' ' GLU . 52.3 t30 -68.44 126.04 92.29 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.184 -0.673 . . . . 8.43 109.184 178.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.48 4.5 2.46 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 123.095 2.53 . . . . 9.16 114.084 -178.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -86.34 -70.56 0.6 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.843 0.354 . . . . 11.34 111.483 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -129.85 27.07 5.22 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.604 -0.271 . . . . 7.75 111.039 -179.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 33.8 t70 60.36 49.29 7.09 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.585 0.707 . . . . 9.08 110.215 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . 0.418 ' OE1' ' HB3' ' B' ' 97' ' ' ASN . 3.3 mp0 -97.8 153.92 17.97 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.876 -0.602 . . . . 7.71 110.123 179.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 46.0 mt -95.84 96.17 5.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 109.506 -0.553 . . . . 8.04 109.506 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -68.02 -47.83 67.37 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.995 -0.548 . . . . 8.81 110.819 -179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' TYR . . . . . 0.44 ' HB2' ' O ' ' B' ' 16' ' ' HIS . 8.8 p90 -167.93 178.39 5.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.406 -0.361 . . . . 7.4 110.41 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 54.0 mt -120.44 115.96 48.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.89 -0.596 . . . . 6.78 110.093 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.562 HG12 ' HG2' ' B' ' 15' ' ' ARG . 19.7 mt -91.25 119.67 38.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 109.36 -0.608 . . . . 6.31 109.36 179.463 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' CYS . . . . . 0.687 ' HB3' HG23 ' B' ' 90' ' ' THR . 71.4 m -111.43 117.88 34.28 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 120.909 0.385 . . . . 5.31 111.812 -179.329 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . 0.588 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 28.9 m -81.54 97.75 7.97 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.965 -1.124 . . . . 5.48 107.965 177.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' ASN . . . . . 0.66 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.5 m-20 -79.39 102.1 8.5 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.708 -0.678 . . . . 6.9 110.906 -178.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -106.04 113.25 26.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.261 -0.427 . . . . 8.61 110.61 179.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -68.89 132.42 46.7 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.82 0.343 . . . . 11.84 110.558 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . 0.414 HG12 ' HG3' ' B' ' 114' ' ' LYS . 52.7 t -111.8 -46.18 5.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.987 -0.552 . . . . 11.77 110.239 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . 0.764 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 59.4 mtpt . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.568 -0.729 . . . . 12.68 109.927 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 57.8 m . . . . . 0 N--CA 1.477 0.92 0 N-CA-C 109.903 -0.406 . . . . 15.6 109.903 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.534 ' HB2' ' CB ' ' A' ' 31' ' ' ALA . 49.8 mm-40 -74.9 128.61 84.87 Favored Pre-proline 0 C--N 1.325 -0.461 0 N-CA-C 110.032 -0.359 . . . . 15.08 110.032 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.31 170.99 18.91 Favored 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 122.545 2.163 . . . . 13.43 112.332 179.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.604 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.1 OUTLIER -84.15 50.83 1.93 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.031 -0.531 . . . . 11.09 111.13 -179.97 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.514 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 3.6 tm-20 -153.61 137.88 16.59 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.591 -0.731 . . . . 10.59 109.036 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.877 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 26.9 p90 -153.22 142.96 21.99 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.091 0.472 . . . . 8.93 110.874 179.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 50.3 mm -82.02 120.57 33.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.795 -0.639 . . . . 8.66 111.083 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.773 ' HB3' ' HE1' ' A' ' 22' ' ' PHE . 1.6 m -103.2 94.24 5.42 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.907 -0.588 . . . . 6.11 110.551 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.604 ' HD3' ' HB3' ' A' ' 24' ' ' PHE . 10.5 mtp180 -85.73 97.25 10.04 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.411 -0.588 . . . . 9.09 109.411 179.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 30.9 p80 -127.66 154.28 45.47 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.682 -0.69 . . . . 9.79 110.251 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.6 p-10 -73.61 178.18 4.89 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.525 -0.307 . . . . 12.69 110.427 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 19.6 pt -56.63 -28.95 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 112.815 0.672 . . . . 13.58 112.815 -179.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -77.57 -17.2 58.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.892 0.377 . . . . 13.85 111.399 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 105.79 -3.22 38.9 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.596 -0.811 . . . . 9.38 112.687 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.501 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 18.2 mm -71.62 117.15 14.51 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 CA-C-O 120.764 0.316 . . . . 10.74 110.687 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.773 ' HE1' ' HB3' ' A' ' 14' ' ' SER . 98.6 m-85 -69.89 125.33 26.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.131 -0.486 . . . . 9.73 110.324 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.3 m -109.42 -21.55 12.45 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.358 0.599 . . . . 7.74 109.96 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.604 ' HB3' ' HD3' ' A' ' 15' ' ' ARG . 23.7 t80 -151.86 116.43 5.09 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 108.882 -0.784 . . . . 6.92 108.882 178.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.629 HG21 ' HB2' ' A' ' 40' ' ' LEU . 3.0 t -109.94 153.1 11.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-O 120.854 0.359 . . . . 6.02 110.917 -178.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.877 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 5.0 t70 -72.0 172.54 9.84 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.91 -0.587 . . . . 7.31 110.358 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 59.6 m170 -96.83 -25.01 15.62 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.319 0.58 . . . . 11.67 109.817 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 54.3 mtm180 -76.11 -4.34 40.99 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.485 -0.779 . . . . 11.91 112.371 -178.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.9 p -59.25 -27.71 66.05 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 120.843 0.354 . . . . 12.99 111.544 -179.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.432 ' O ' ' HA2' ' A' ' 34' ' ' GLY . 24.4 t -62.57 -34.94 67.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.98 -0.555 . . . . 16.15 110.923 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.534 ' CB ' ' HB2' ' A' ' 8' ' ' GLN . . . -93.48 -6.28 47.25 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.875 0.369 . . . . 15.07 111.011 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.8 m -90.99 -55.55 3.51 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.996 0.427 . . . . 14.9 110.304 179.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.541 HG11 ' HD2' ' A' ' 78' ' ' PHE . 3.7 m -123.56 -21.25 3.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-N 115.905 -0.589 . . . . 13.84 111.42 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.432 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 101.73 -17.49 54.71 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.391 -0.909 . . . . 13.85 112.147 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.466 ' H ' HG23 ' A' ' 33' ' ' VAL . 7.3 m-85 -71.41 137.2 48.13 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.806 0.336 . . . . 18.28 110.554 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.425 HE22 HG13 ' A' ' 30' ' ' VAL . 34.1 mm-40 -79.25 152.23 76.08 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.197 -0.668 . . . . 15.48 109.197 179.026 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.519 ' HB3' ' HB ' ' A' ' 25' ' ' VAL . 50.8 Cg_exo -53.89 -38.65 86.06 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.454 2.103 . . . . 11.63 112.168 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.42 ' HA ' HD12 ' A' ' 41' ' ' LEU . 26.2 mp0 -68.48 -16.61 63.95 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.833 -0.621 . . . . 13.31 111.624 -179.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -82.17 -23.48 35.51 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.991 0.424 . . . . 17.34 109.909 179.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.629 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.6 mm? -92.67 -32.24 14.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.874 -0.603 . . . . 13.25 110.288 179.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 86.8 mt -54.92 119.15 4.98 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.091 -0.504 . . . . 12.99 111.496 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.47 4.97 85.35 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.855 -0.688 . . . . 13.39 112.984 179.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.636 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 7.7 mmpt? -114.78 157.93 22.57 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 122.556 -0.379 . . . . 16.87 110.556 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.696 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 16.1 m120 -92.4 134.19 35.17 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.672 -0.492 . . . . 12.5 109.672 179.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.48 HD13 ' HZ ' ' A' ' 61' ' ' PHE . 11.3 tt -56.63 -30.39 31.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-O 120.991 0.424 . . . . 11.72 111.452 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.8 p -70.53 -17.94 20.89 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 CA-C-N 116.247 -0.433 . . . . 12.89 111.753 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.696 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.2 mt-10 -72.48 -34.21 67.53 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.958 0.408 . . . . 16.53 110.431 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.456 ' HE1' ' HB3' ' A' ' 43' ' ' LYS . 68.3 m-85 -99.87 21.16 13.0 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.807 -0.633 . . . . 15.34 110.299 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 13.2 t -108.06 150.49 27.09 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.781 -0.645 . . . . 11.97 110.733 -179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.532 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 2.1 t-160 -56.09 128.17 71.23 Favored Pre-proline 0 C--N 1.333 -0.139 0 N-CA-C 109.019 -0.734 . . . . 14.67 109.019 178.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.429 ' HD2' ' CD2' ' A' ' 50' ' ' HIS . 5.7 Cg_endo -50.37 -40.91 52.82 Favored 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 122.777 2.318 . . . . 15.15 112.828 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -75.51 -14.55 60.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.484 -0.326 . . . . 16.47 111.36 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.532 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 34.5 m-20 -103.39 -6.63 21.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.605 -0.27 . . . . 13.16 111.203 -179.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 81.7 mt-30 -56.59 -42.56 78.88 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 15.83 111.344 -179.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 49.0 tp60 -64.68 -45.28 87.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.43 -0.35 . . . . 13.94 110.425 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.9 tp -59.55 -42.44 92.38 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.998 -0.546 . . . . 12.11 110.505 179.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.494 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.5 OUTLIER -63.16 -54.5 36.68 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.081 -0.509 . . . . 9.71 110.617 179.46 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 56.4 ttt180 -58.53 -41.02 84.55 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.08 -0.509 . . . . 11.06 110.919 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -60.38 -43.33 96.71 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.958 -0.564 . . . . 9.71 110.579 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 16.6 m -70.19 -32.58 70.57 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.791 -0.64 . . . . 9.52 111.148 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.548 ' O ' HG12 ' A' ' 64' ' ' VAL . 8.3 m-85 -62.09 -50.39 72.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.948 0.404 . . . . 11.4 110.488 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -67.86 -30.77 70.23 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.707 -0.479 . . . . 10.04 109.707 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -63.17 -45.32 92.34 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.633 -0.712 . . . . 10.6 110.915 179.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.548 HG12 ' O ' ' A' ' 61' ' ' PHE . 1.9 p -67.2 -24.1 31.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-O 120.813 0.34 . . . . 10.62 110.576 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.467 ' O ' ' HG3' ' A' ' 68' ' ' LYS . 69.3 t -72.43 -38.93 61.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 N-CA-C 108.963 -0.754 . . . . 12.41 108.963 178.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 42.1 mtpt -73.46 -30.36 63.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.377 -0.829 . . . . 16.25 109.766 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 22.0 mt -68.36 -57.45 5.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.558 -0.747 . . . . 12.66 110.33 179.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.467 ' HG3' ' O ' ' A' ' 65' ' ' VAL . 67.7 mttt 62.97 83.47 0.16 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 115.685 -0.689 . . . . 14.83 112.175 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.51 -47.72 1.0 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.579 -0.82 . . . . 9.8 113.127 178.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -71.6 136.22 47.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.944 0.402 . . . . 9.59 110.599 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.522 ' HB ' ' HZ ' ' B' ' 24' ' ' PHE . 4.1 p -80.44 123.94 37.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.611 -0.722 . . . . 8.1 110.229 179.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 25.2 tp -107.14 109.56 21.42 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.067 0.461 . . . . 7.8 110.569 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.428 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 1.3 m -89.56 109.04 20.02 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.796 -0.638 . . . . 7.59 110.923 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 p -103.8 129.71 55.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 116.403 -0.362 . . . . 7.84 110.082 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 26.2 ttt -104.28 115.08 29.76 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.096 0.474 . . . . 9.35 110.433 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.565 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 31.6 p90 -145.86 178.58 8.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.797 -0.638 . . . . 9.66 109.975 -179.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.806 ' HB3' ' HB3' ' A' ' 85' ' ' TRP . 9.0 mtt180 -98.14 116.51 30.51 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.836 0.35 . . . . 13.1 110.472 179.256 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.565 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 19.4 t80 -100.95 147.29 26.33 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.107 -0.497 . . . . 9.28 109.897 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.424 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 37.9 ttp180 -81.91 132.59 35.27 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.858 0.361 . . . . 10.87 111.001 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.469 ' HA ' ' HB ' ' A' ' 33' ' ' VAL . 54.6 p -95.94 -176.69 3.78 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.078 -0.51 . . . . 10.77 110.108 179.142 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.5 tptt -69.64 -18.74 63.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.344 0.592 . . . . 12.66 109.614 178.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 56.4 m-20 -91.38 5.33 49.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.634 -0.712 . . . . 14.42 109.685 179.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 65.51 23.71 11.83 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.115 -0.948 . . . . 12.69 111.659 179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -98.71 164.89 12.05 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.123 -0.695 . . . . 10.85 109.123 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.806 ' HB3' ' HB3' ' A' ' 77' ' ' ARG . 55.2 m95 -109.61 112.63 24.83 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.133 0.492 . . . . 11.2 111.29 -178.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.485 HD21 HG12 ' A' ' 33' ' ' VAL . 1.3 pp -108.66 150.31 27.72 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.77 -0.65 . . . . 11.12 110.17 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -76.34 116.35 16.94 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.019 0.437 . . . . 10.28 110.487 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 18.2 tpp -116.86 129.05 55.83 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.75 -0.659 . . . . 9.32 110.718 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.3 ttp180 -100.66 77.4 1.89 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.471 -0.937 . . . . 10.66 108.471 178.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.412 HG23 ' HB3' ' A' ' 108' ' ' CYS . 61.2 m -69.54 108.37 3.78 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.353 -0.84 . . . . 9.37 113.033 -177.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.449 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 1.5 m -86.78 95.1 9.72 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.947 -0.76 . . . . 8.27 108.947 177.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.3 m -83.63 130.71 34.98 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.005 0.372 . . . . 8.65 112.005 -178.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 38.2 t80 -124.58 129.07 49.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.714 -0.675 . . . . 11.56 110.057 179.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.38 115.23 15.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.29 -0.414 . . . . 10.16 111.001 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -89.99 106.18 18.3 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 120.968 0.413 . . . . 12.25 110.314 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.616 ' HG2' HG12 ' A' ' 103' ' ' ILE . 16.6 mt-30 -114.8 156.93 23.98 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.776 -0.647 . . . . 14.24 110.689 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.433 ' HB2' ' OE2' ' A' ' 102' ' ' GLU . 92.1 m-20 -95.2 149.09 35.7 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 109.096 -0.705 . . . . 13.83 109.096 178.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -83.15 18.42 1.5 Allowed 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 122.581 2.187 . . . . 15.34 112.58 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 9.0 m-85 -97.71 -66.57 0.89 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.369 -0.378 . . . . 16.89 110.903 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.4 m -126.01 20.28 7.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.459 -0.337 . . . . 14.89 110.522 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 12.7 t70 60.41 33.51 20.7 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 115.715 -0.675 . . . . 14.77 110.94 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.433 ' OE2' ' HB2' ' A' ' 97' ' ' ASN . 0.5 OUTLIER -78.05 136.9 38.0 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.936 -0.575 . . . . 12.95 110.154 -179.826 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.616 HG12 ' HG2' ' A' ' 96' ' ' GLN . 45.8 mt -94.0 114.19 30.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.84 -0.43 . . . . 11.11 109.84 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -77.32 -53.56 7.55 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.828 0.347 . . . . 11.65 110.78 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 15.4 p90 -158.17 -178.27 7.17 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.271 -0.422 . . . . 10.3 110.525 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 24.4 mt -113.34 116.16 51.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.96 -0.564 . . . . 10.29 110.072 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 59.3 mt -83.21 100.1 6.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 116.14 -0.482 . . . . 8.99 109.875 179.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.432 ' HB2' ' HB2' ' A' ' 14' ' ' SER . 51.8 m -94.68 114.71 26.67 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.243 -0.435 . . . . 9.83 111.33 -179.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.449 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 4.0 m -87.51 93.02 9.29 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.912 -0.773 . . . . 10.84 108.912 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.514 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 6.2 m-20 -78.3 99.23 6.22 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.849 -0.614 . . . . 11.26 112.019 -178.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.796 HG21 HH12 ' B' ' 28' ' ' ARG . 0.7 OUTLIER -107.22 117.74 34.87 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.883 -0.414 . . . . 11.22 109.883 178.306 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . 0.604 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 8.5 t-20 -76.53 130.13 37.47 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.016 0.436 . . . . 12.78 110.975 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 28.9 t -104.77 -54.79 6.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 115.622 -0.717 . . . . 14.64 109.576 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 46.7 mtpt . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.141 -0.933 . . . . 16.02 110.006 -179.656 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 77.2 m . . . . . 0 N--CA 1.477 0.887 0 N-CA-C 110.173 -0.306 . . . . 7.49 110.173 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -120.72 151.5 54.51 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-N 116.565 -0.289 . . . . 7.12 110.224 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -66.06 161.13 41.24 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.751 2.3 . . . . 6.18 112.664 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . 0.475 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.3 OUTLIER -82.09 59.81 4.59 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.834 -0.621 . . . . 5.81 111.364 -179.499 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.525 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -156.38 153.28 28.69 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.811 -0.811 . . . . 5.85 108.811 179.184 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -158.83 158.54 33.68 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.137 0.494 . . . . 6.08 111.358 179.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.583 ' HB ' ' HB2' ' B' ' 26' ' ' ASP . 21.5 mm -93.35 117.05 35.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.541 -0.754 . . . . 5.57 110.09 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.672 ' HB3' ' HE2' ' B' ' 22' ' ' PHE . 0.6 OUTLIER -107.32 96.31 6.32 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.094 -0.503 . . . . 5.3 111.303 -179.084 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . 0.666 ' HD3' ' HB3' ' B' ' 24' ' ' PHE . 23.5 mtp85 -90.66 107.7 19.34 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.908 -0.775 . . . . 8.97 108.908 179.046 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . 0.468 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 31.3 p80 -136.98 165.55 25.72 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.63 -0.259 . . . . 8.31 111.45 -178.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -77.94 177.33 8.34 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 116.038 -0.528 . . . . 10.83 110.245 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 22.8 pt -58.11 -30.48 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 N-CA-C 112.917 0.71 . . . . 8.89 112.917 -178.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -78.63 -16.85 56.87 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.08 0.467 . . . . 11.92 111.495 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 108.16 -1.12 33.25 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.432 -0.89 . . . . 8.57 112.359 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . 0.508 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 33.1 mm -69.56 111.87 3.88 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 N-CA-C 109.805 -0.443 . . . . 10.87 109.805 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . 0.672 ' HE2' ' HB3' ' B' ' 14' ' ' SER . 57.1 m-85 -63.57 126.72 28.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.248 -0.433 . . . . 8.23 110.972 -179.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 1.4 m -100.64 -33.37 10.32 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.957 -0.565 . . . . 7.91 110.237 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . 0.666 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 32.3 t80 -156.62 127.33 6.72 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.693 -0.685 . . . . 7.89 109.437 179.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 15.0 t -115.02 138.3 45.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-N 116.434 -0.348 . . . . 6.1 110.672 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . 0.583 ' HB2' ' HB ' ' B' ' 13' ' ' ILE . 9.6 t70 -75.02 141.65 43.89 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.058 -0.519 . . . . 7.15 109.698 179.173 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 18.4 m170 -70.4 87.54 0.63 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.05 0.453 . . . . 8.97 110.185 179.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . 0.796 HH12 HG21 ' A' ' 111' ' ' THR . 12.5 mtm180 -169.53 -21.57 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.022 -0.99 . . . . 9.76 110.408 -179.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' CYS . . . . . 0.419 ' H ' ' H ' ' B' ' 28' ' ' ARG . 24.3 p -55.86 -30.53 61.65 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.601 0.593 . . . . 11.56 112.601 -178.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.4 ' O ' ' HA2' ' B' ' 34' ' ' GLY . 3.2 t -68.36 -21.84 26.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.138 0.494 . . . . 13.64 110.782 -179.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -96.25 -19.49 19.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.151 -0.477 . . . . 12.9 110.039 178.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 2.5 m -85.61 -60.02 2.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.978 -0.555 . . . . 12.13 111.303 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' VAL . . . . . 0.523 HG11 ' HD2' ' B' ' 78' ' ' PHE . 3.5 m -116.58 -14.52 10.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.808 0.337 . . . . 13.87 111.586 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' GLY . . . . . 0.4 ' HA2' ' O ' ' B' ' 30' ' ' VAL . . . 91.82 -2.96 77.27 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.503 -0.856 . . . . 13.79 112.817 179.379 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' TYR . . . . . 0.443 ' H ' HG23 ' B' ' 33' ' ' VAL . 5.4 m-85 -82.32 137.8 34.7 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.716 0.293 . . . . 15.38 110.62 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . 0.827 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 77.5 mm-40 -73.21 146.75 87.27 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 116.092 -0.504 . . . . 13.78 109.769 179.114 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.566 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 51.1 Cg_exo -53.89 -39.76 83.28 Favored 'Trans proline' 0 CA--C 1.529 0.27 0 C-N-CA 122.38 2.053 . . . . 14.71 112.125 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -69.34 -14.52 62.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.849 -0.614 . . . . 17.54 111.864 -179.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.827 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 29.3 mt-10 -82.72 -21.07 34.93 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.94 0.4 . . . . 14.24 110.368 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.46 ' HB3' ' CG ' ' B' ' 22' ' ' PHE . 1.2 mm? -94.57 -28.5 15.37 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.802 -0.635 . . . . 14.03 110.016 179.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 87.1 mt -62.71 119.21 8.84 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.986 -0.552 . . . . 13.62 110.692 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 90.24 -2.98 81.97 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.911 -0.661 . . . . 11.62 112.097 -179.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.508 ' O ' ' HA ' ' B' ' 21' ' ' ILE . 1.5 mmpt? -109.14 161.66 15.0 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.681 0.277 . . . . 13.82 110.29 179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' ASN . . . . . 0.788 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 15.4 m120 -96.63 135.24 38.81 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.484 -0.562 . . . . 10.16 109.484 179.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.1 tt -60.68 -22.65 26.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.224 0.535 . . . . 9.62 110.75 179.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' VAL . . . . . 0.4 HG12 ' HB3' ' B' ' 44' ' ' ASN . 9.9 p -74.59 -18.19 16.65 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 116.052 -0.522 . . . . 11.5 111.196 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . 0.788 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 36.5 mt-10 -73.85 -38.25 64.55 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.959 0.409 . . . . 11.89 110.877 -179.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' PHE . . . . . 0.506 ' HB2' ' CZ ' ' B' ' 78' ' ' PHE . 25.4 m-85 -96.34 18.28 14.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.018 -0.537 . . . . 13.6 110.575 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 51.9 t -103.11 149.56 24.49 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.071 -0.513 . . . . 10.81 110.647 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' HIS . . . . . 0.668 ' HB3' ' HB2' ' B' ' 53' ' ' ASP . 9.3 t-160 -57.19 127.63 76.7 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.663 -0.699 . . . . 11.49 109.17 178.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_exo -45.06 -50.8 8.37 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.083 2.522 . . . . 11.35 113.438 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 13.5 mp0 -75.08 4.15 7.26 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.447 0.536 . . . . 9.28 112.447 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . 0.668 ' HB2' ' HB3' ' B' ' 50' ' ' HIS . 6.0 m-20 -122.46 -0.22 9.3 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.108 0.48 . . . . 7.52 110.341 179.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -66.69 -38.37 86.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.802 -0.635 . . . . 6.57 110.794 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 48.1 tp60 -65.65 -45.21 83.84 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.682 -0.488 . . . . 6.58 109.682 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 40.7 tp -58.77 -42.49 89.07 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.482 -0.781 . . . . 4.6 110.573 179.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.517 ' HA ' HD23 ' B' ' 57' ' ' LEU . 1.1 mt -63.02 -54.55 36.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.032 -0.531 . . . . 6.4 110.777 179.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 42.2 ttt180 -58.36 -43.63 88.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 8.18 111.059 -179.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -60.14 -46.04 91.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.042 -0.526 . . . . 6.07 110.645 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 42.5 m -63.92 -39.02 93.21 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.069 -0.514 . . . . 5.59 110.726 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' PHE . . . . . 0.457 ' O ' HG12 ' B' ' 64' ' ' VAL . 9.7 m-85 -62.95 -44.13 96.91 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 120.829 0.347 . . . . 7.73 110.287 179.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -66.93 -35.0 79.0 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.309 -0.405 . . . . 6.89 110.375 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.407 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 27.2 mt-30 -69.92 -40.76 75.37 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.109 -0.496 . . . . 9.4 111.593 -179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.457 ' HA ' HD12 ' B' ' 67' ' ' LEU . 9.8 p -70.02 -25.96 28.92 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-O 120.917 0.389 . . . . 7.57 110.832 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . 0.625 ' HA ' HG21 ' B' ' 94' ' ' THR . 24.6 t -68.44 -32.81 56.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.389 0.614 . . . . 7.43 109.407 178.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -78.53 -11.49 59.96 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.475 -0.784 . . . . 10.21 110.85 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.624 ' HB3' ' HB2' ' B' ' 70' ' ' GLN . 96.8 mt -82.7 -55.7 4.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.128 -0.487 . . . . 7.2 109.996 179.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 79.8 mttt 66.18 111.22 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.492 -0.777 . . . . 7.58 111.702 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . 0.433 ' HA3' ' OE1' ' B' ' 96' ' ' GLN . . . 75.98 19.54 78.63 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.626 -0.797 . . . . 5.57 112.291 179.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . 0.624 ' HB2' ' HB3' ' B' ' 67' ' ' LEU . 26.6 mm-40 -128.45 163.66 24.42 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.665 -0.495 . . . . 5.43 109.665 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' VAL . . . . . 0.443 ' HB ' ' HD1' ' B' ' 93' ' ' PHE . 9.8 p -116.72 131.16 70.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-O 121.27 0.557 . . . . 5.65 111.068 -179.232 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 21.0 tp -118.46 116.02 25.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.932 -0.577 . . . . 4.51 109.616 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.8 m -92.31 114.77 27.41 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.836 -0.62 . . . . 6.35 111.351 -179.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . 0.437 HG13 ' HB ' ' B' ' 90' ' ' THR . 2.5 p -108.04 128.8 63.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.931 -0.577 . . . . 4.34 110.0 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 27.9 ttt -102.16 108.08 19.37 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.032 0.444 . . . . 5.42 110.525 -179.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.426 ' HE2' ' HD1' ' B' ' 78' ' ' PHE . 26.8 p90 -138.49 -171.45 3.06 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.895 -0.593 . . . . 3.54 109.893 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' ARG . . . . . 0.615 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 59.0 mtm180 -114.66 119.29 36.23 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.15 0.5 . . . . 6.8 110.53 179.27 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.523 ' HD2' HG11 ' B' ' 33' ' ' VAL . 19.7 t80 -99.53 144.85 28.15 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.451 -0.795 . . . . 5.79 110.504 -179.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' ARG . . . . . . . . . . . . . 39.7 ttp180 -82.62 120.02 25.01 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.365 -0.38 . . . . 11.08 110.208 179.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . 0.486 ' OG ' ' HG2' ' B' ' 84' ' ' GLU . 99.8 p -87.71 -175.21 5.09 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.841 0.353 . . . . 7.47 110.747 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 39.8 tptt -66.37 -16.72 64.29 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.023 -0.535 . . . . 12.24 110.418 179.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 23.7 m-20 -92.84 4.18 54.32 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.02 -0.536 . . . . 9.25 109.837 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 68.86 16.36 8.85 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.323 -0.853 . . . . 8.3 112.029 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . 0.486 ' HG2' ' OG ' ' B' ' 80' ' ' SER . 13.4 pt-20 -97.01 148.08 23.35 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.683 -0.488 . . . . 6.78 109.683 179.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . 0.615 ' HB3' ' HB3' ' B' ' 77' ' ' ARG . 2.7 m95 -95.05 103.63 15.49 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.089 -0.337 . . . . 7.89 110.089 -179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.509 HD21 HG12 ' B' ' 33' ' ' VAL . 1.6 pp -97.45 146.43 25.22 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.515 -0.311 . . . . 6.97 110.645 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 87' ' ' TRP . . . . . 0.59 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 87.0 m95 -72.8 116.97 13.93 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.392 -0.367 . . . . 8.55 110.111 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 88' ' ' MET . . . . . 0.416 ' SD ' ' HB3' ' B' ' 110' ' ' ASN . 3.9 ttp -131.3 134.57 46.49 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.01 -0.541 . . . . 4.46 110.657 -179.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 37.5 ttp180 -96.98 105.28 17.4 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.72 -0.673 . . . . 6.87 109.353 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 90' ' ' THR . . . . . 0.776 HG23 ' HB3' ' B' ' 108' ' ' CYS . 19.7 m -88.32 106.89 18.53 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.895 -0.593 . . . . 6.18 111.014 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 91' ' ' SER . . . . . 0.454 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 0.8 OUTLIER -87.9 88.58 7.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.827 -0.624 . . . . 6.3 109.321 179.129 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 9.3 m -80.49 122.65 27.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.082 -0.508 . . . . 6.65 111.968 -178.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . 0.443 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 77.6 t80 -115.47 125.46 53.11 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.261 -0.427 . . . . 6.45 109.949 178.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . 0.625 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.4 OUTLIER -88.33 104.3 16.63 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.757 0.313 . . . . 9.17 110.735 179.763 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -71.7 132.45 44.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.307 -0.406 . . . . 8.33 110.541 -179.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 96' ' ' GLN . . . . . 0.433 ' OE1' ' HA3' ' B' ' 69' ' ' GLY . 50.9 mt-30 -99.0 137.65 37.23 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.851 -0.613 . . . . 10.53 111.851 -178.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 97' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -89.85 124.13 64.51 Favored Pre-proline 0 C--N 1.323 -0.568 0 N-CA-C 108.329 -0.989 . . . . 8.43 108.329 177.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.54 51.19 1.11 Allowed 'Trans proline' 0 CA--C 1.534 0.479 0 C-N-CA 123.137 2.558 . . . . 9.16 113.703 -179.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 47.4 m-85 -138.02 -77.82 0.37 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.547 -0.297 . . . . 11.34 110.425 179.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 14.7 m -113.24 20.11 16.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.128 0.49 . . . . 7.75 109.908 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 7.6 t0 61.66 35.03 17.27 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.087 -0.961 . . . . 9.08 111.341 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -82.07 164.93 21.04 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.967 -0.561 . . . . 7.71 109.767 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 69.4 mt -103.33 118.77 50.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.486 -0.324 . . . . 8.04 110.284 179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -66.09 -64.26 0.9 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.063 0.458 . . . . 8.81 109.788 179.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 6.6 p90 -157.92 172.47 18.4 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.392 -0.822 . . . . 7.4 109.666 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 57.8 mt -102.96 113.16 38.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 116.403 -0.362 . . . . 6.78 110.081 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 13.2 mt -88.91 105.52 15.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 109.332 -0.618 . . . . 6.31 109.332 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' CYS . . . . . 0.776 ' HB3' HG23 ' B' ' 90' ' ' THR . 97.1 m -99.25 106.1 18.19 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.375 0.509 . . . . 5.31 112.375 -178.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . 0.454 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 2.9 m -79.89 84.26 5.69 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.647 -0.872 . . . . 5.48 108.647 177.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' ASN . . . . . 0.416 ' HB3' ' SD ' ' B' ' 88' ' ' MET . 7.3 m-20 -71.16 121.71 18.82 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.552 -0.749 . . . . 6.9 111.752 -178.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.13 116.63 22.36 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.213 -0.448 . . . . 8.61 110.111 179.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 112' ' ' ASN . . . . . 0.475 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 8.1 t-20 -68.44 135.3 51.49 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.116 0.484 . . . . 11.84 110.875 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 2.0 t -109.12 -50.12 7.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.683 -0.69 . . . . 11.77 109.9 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . 0.59 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 92.0 mttt . . . . . 0 C--O 1.246 0.905 0 CA-C-O 118.61 -0.71 . . . . 12.68 109.829 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.2 m . . . . . 0 N--CA 1.476 0.871 0 N-CA-C 110.45 -0.204 . . . . 15.6 110.45 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.428 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 74.1 mm-40 -87.52 111.52 42.21 Favored Pre-proline 0 C--N 1.326 -0.456 0 N-CA-C 109.794 -0.447 . . . . 15.08 109.794 178.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 8' ' ' GLN . 13.1 Cg_exo -69.57 159.9 51.79 Favored 'Trans proline' 0 C--O 1.233 0.271 0 C-N-CA 122.805 2.337 . . . . 13.43 112.664 -179.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.506 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.0 OUTLIER -86.87 55.77 3.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.853 -0.612 . . . . 11.09 110.233 179.79 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.479 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 8.8 tt0 -157.55 144.06 17.9 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.492 -0.776 . . . . 10.59 109.728 -178.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.818 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 27.2 p90 -150.63 143.58 24.69 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.066 0.46 . . . . 8.93 111.114 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.471 HG23 HG23 ' A' ' 107' ' ' ILE . 50.5 mm -80.0 115.23 22.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.902 -0.59 . . . . 8.66 110.444 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.917 ' HB3' ' HE2' ' A' ' 22' ' ' PHE . 1.6 m -100.21 99.52 10.22 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.986 -0.552 . . . . 6.11 110.94 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.646 ' HD3' ' HB3' ' A' ' 24' ' ' PHE . 15.1 mtp180 -91.72 106.7 18.67 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.419 -0.586 . . . . 9.09 109.419 179.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.8 p80 -133.73 159.98 38.94 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.507 -0.315 . . . . 9.79 110.887 -179.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -75.82 179.32 5.55 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.336 -0.393 . . . . 12.69 110.618 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.1 pt -53.93 -36.45 30.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 112.528 0.566 . . . . 13.58 112.528 -179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -68.82 -46.47 68.54 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.989 0.424 . . . . 13.85 111.039 -179.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 137.22 -8.46 3.79 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.609 -0.805 . . . . 9.38 111.724 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.463 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 33.5 mm -64.99 116.1 3.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 109.908 -0.405 . . . . 10.74 109.908 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.917 ' HE2' ' HB3' ' A' ' 14' ' ' SER . 89.7 m-85 -66.82 122.33 17.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.156 -0.474 . . . . 9.73 110.885 -179.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.82 -32.59 13.89 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.678 -0.692 . . . . 7.74 109.735 179.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.646 ' HB3' ' HD3' ' A' ' 15' ' ' ARG . 55.1 t80 -147.43 133.63 19.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.517 -0.765 . . . . 6.92 109.337 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.506 HG21 ' HB2' ' A' ' 40' ' ' LEU . 22.1 t -119.41 147.19 23.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.253 0.549 . . . . 6.02 111.606 -178.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.818 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 5.4 t70 -68.8 -179.55 1.47 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 114.911 -1.04 . . . . 7.31 110.499 179.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 25.8 m170 -108.34 -20.29 13.18 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.105 0.479 . . . . 11.67 110.226 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 63.9 mtm180 -76.94 -6.68 53.51 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.83 -0.623 . . . . 11.91 111.272 -179.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 25.1 p -57.65 -31.23 66.09 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.344 -0.389 . . . . 12.99 111.376 -179.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.491 ' O ' ' HA2' ' A' ' 34' ' ' GLY . 13.4 t -62.84 -31.43 52.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.943 -0.571 . . . . 16.15 111.057 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -92.77 -17.54 24.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.966 0.412 . . . . 15.07 110.781 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.443 ' HA ' HG22 ' A' ' 10' ' ' THR . 5.3 m -82.11 -67.33 0.79 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.067 -0.515 . . . . 14.9 110.927 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 2.4 m -113.11 -8.79 12.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.381 -0.372 . . . . 13.84 111.51 -179.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.491 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 85.56 -2.64 87.9 Favored Glycine 0 N--CA 1.453 -0.203 0 C-N-CA 120.519 -0.848 . . . . 13.85 112.234 179.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -78.16 136.7 37.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.858 0.361 . . . . 18.28 110.771 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.556 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 26.0 mm-40 -77.98 149.31 76.65 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 108.708 -0.849 . . . . 15.48 108.708 178.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.432 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 76.4 Cg_exo -51.3 -38.19 61.63 Favored 'Trans proline' 0 CA--C 1.53 0.287 0 C-N-CA 122.555 2.17 . . . . 11.63 112.853 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.531 ' HA ' HD12 ' A' ' 41' ' ' LEU . 19.9 mp0 -71.67 -14.84 62.16 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.155 -0.475 . . . . 13.31 111.729 -179.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.556 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 31.5 mt-10 -81.18 -22.8 38.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.788 0.328 . . . . 17.34 110.295 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.506 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.9 mm? -94.68 -34.68 12.48 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.978 -0.555 . . . . 13.25 109.989 179.519 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.531 HD12 ' HA ' ' A' ' 38' ' ' GLN . 82.5 mt -57.88 120.89 9.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.808 -0.633 . . . . 12.99 111.068 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 85.15 3.3 87.52 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.66 -0.781 . . . . 13.39 112.471 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.758 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 8.7 mmpt? -112.64 163.25 14.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.86 0.362 . . . . 16.87 110.3 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.682 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 7.8 m120 -96.41 137.53 35.34 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.997 -0.547 . . . . 12.5 110.008 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 19.7 tt -63.47 -23.37 33.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.113 0.482 . . . . 11.72 111.075 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.44 HG12 ' HB3' ' A' ' 44' ' ' ASN . 8.3 p -78.73 -16.49 13.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.275 -0.42 . . . . 12.89 111.445 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.682 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.2 mt-10 -69.36 -39.83 77.86 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.019 0.437 . . . . 16.53 110.817 -179.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.416 ' HB2' ' CZ ' ' A' ' 78' ' ' PHE . 22.8 m-85 -97.91 23.89 7.54 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.015 -0.539 . . . . 15.34 110.402 -179.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 52.4 t -104.94 147.18 28.06 Favored 'General case' 0 C--N 1.319 -0.717 0 CA-C-N 115.847 -0.615 . . . . 11.97 110.066 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.461 ' CD2' ' HD2' ' A' ' 51' ' ' PRO . 8.4 t-160 -58.98 127.38 83.48 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 116.128 -0.487 . . . . 14.67 109.734 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.461 ' HD2' ' CD2' ' A' ' 50' ' ' HIS . 88.9 Cg_exo -43.6 -50.73 6.74 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.308 2.672 . . . . 15.15 113.77 -179.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -70.49 -3.27 17.02 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.48 0.548 . . . . 16.47 112.48 -179.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -120.58 1.83 10.64 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 122.195 -0.315 . . . . 13.16 110.901 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -62.85 -47.45 83.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.175 -0.466 . . . . 15.83 111.406 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 44.8 tp60 -69.38 -34.71 74.94 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.57 -0.53 . . . . 13.94 109.57 178.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.7 tp -57.76 -40.87 80.78 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.34 0.59 . . . . 12.11 109.81 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.407 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.7 OUTLIER -66.81 -46.06 76.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.468 -0.787 . . . . 9.71 110.02 179.052 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 69.1 ttt180 -61.45 -43.67 98.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.143 -0.481 . . . . 11.06 110.775 -179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -58.91 -39.13 80.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.214 0.53 . . . . 9.71 110.288 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.3 m -72.36 -33.9 67.61 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.679 -0.691 . . . . 9.52 110.618 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.523 ' O ' HG12 ' A' ' 64' ' ' VAL . 4.6 m-85 -64.29 -45.99 85.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.887 0.375 . . . . 11.4 110.207 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -64.15 -33.06 74.92 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.991 0.424 . . . . 10.04 109.928 179.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -64.77 -48.87 72.95 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.777 -0.647 . . . . 10.6 110.724 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.603 ' HA ' HD12 ' A' ' 67' ' ' LEU . 4.2 p -65.17 -26.93 40.92 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 CA-C-N 116.646 -0.252 . . . . 10.62 111.268 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 61' ' ' PHE . 55.5 t -69.31 -37.28 75.48 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-O 121.299 0.571 . . . . 12.41 109.694 178.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 27.4 mtpt -78.99 -33.0 45.42 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.794 -0.639 . . . . 16.25 109.946 179.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.727 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 66.6 mt -60.0 -56.56 20.14 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.914 -0.584 . . . . 12.66 110.639 179.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 65.3 mttt 62.21 103.65 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 O-C-N 123.861 0.726 . . . . 14.83 112.163 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 83.69 19.81 61.03 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.369 -0.919 . . . . 9.8 112.132 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.727 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 7.9 tp-100 -128.84 139.35 52.21 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.167 -0.679 . . . . 9.59 109.167 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.487 ' CG2' ' HB3' ' A' ' 91' ' ' SER . 2.6 p -97.25 117.4 41.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.129 0.49 . . . . 8.1 110.383 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 46.4 tp -106.33 117.08 33.11 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.907 -0.588 . . . . 7.8 110.488 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.531 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 9.1 m -93.79 106.93 18.87 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.054 -0.521 . . . . 7.59 110.97 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 3.2 p -99.67 132.02 45.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 116.186 -0.461 . . . . 7.84 110.19 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 23.6 ttt -102.86 119.45 38.86 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.344 -0.389 . . . . 9.35 110.344 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.501 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 46.8 p90 -150.32 -174.67 4.81 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.787 -0.642 . . . . 9.66 109.385 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.464 ' HA ' ' O ' ' A' ' 86' ' ' LEU . 36.1 mtm180 -107.38 121.79 45.29 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.153 0.501 . . . . 13.1 110.954 179.412 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.501 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 13.0 t80 -104.12 148.46 26.24 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.352 -0.84 . . . . 9.28 109.728 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.616 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 1.1 ttt180 -88.09 123.67 33.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.9 0.381 . . . . 10.87 110.735 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.557 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 85.2 p -85.38 -176.5 6.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.018 -0.537 . . . . 10.77 109.908 179.035 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.436 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 35.4 tptt -67.97 -17.3 64.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.321 0.581 . . . . 12.66 109.755 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -88.34 2.92 51.51 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.581 -0.736 . . . . 14.42 110.247 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 67.23 19.32 10.3 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 115.596 -0.729 . . . . 12.69 110.842 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.557 ' HG2' ' OG ' ' A' ' 80' ' ' SER . 5.8 pt-20 -94.59 154.37 17.4 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.087 -0.506 . . . . 10.85 109.902 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.616 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 44.7 m95 -101.36 105.77 16.86 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.422 -0.354 . . . . 11.2 110.61 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.481 HD13 HD22 ' A' ' 112' ' ' ASN . 1.5 pp -107.92 151.63 25.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.23 -0.441 . . . . 11.12 110.385 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.571 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 89.8 m95 -78.43 120.88 23.79 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.073 0.463 . . . . 10.28 110.7 -179.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 5.9 tpp -122.96 140.2 53.27 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.748 -0.66 . . . . 9.32 111.071 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -102.44 94.37 5.65 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.343 -0.984 . . . . 10.66 108.343 177.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.584 HG23 ' HB3' ' A' ' 108' ' ' CYS . 45.4 m -86.92 105.21 16.93 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.893 -0.594 . . . . 9.37 112.048 -178.591 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.811 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 70.8 m -88.29 92.34 9.13 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.981 -0.554 . . . . 8.27 109.629 178.341 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' A' ' 108' ' ' CYS . 14.5 m -81.08 124.03 28.87 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.809 -0.632 . . . . 8.65 111.03 -178.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -121.57 120.16 34.02 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.815 -0.63 . . . . 11.56 109.488 178.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.09 115.11 10.93 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.875 0.369 . . . . 10.16 111.199 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -92.34 109.47 20.85 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.236 -0.438 . . . . 12.25 109.97 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.405 ' HA ' ' HA ' ' A' ' 103' ' ' ILE . 38.3 mt-30 -104.68 152.09 22.92 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.818 -0.628 . . . . 14.24 111.316 -179.26 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -91.75 137.95 25.26 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 115.67 -0.695 . . . . 13.83 109.425 179.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -73.6 36.59 0.39 Allowed 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 122.695 2.263 . . . . 15.34 113.451 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -109.77 -68.61 0.91 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.786 0.327 . . . . 16.89 110.545 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.64 20.68 8.57 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.335 -0.393 . . . . 14.89 110.806 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 24.2 t70 67.8 23.61 8.46 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.55 0.691 . . . . 14.77 110.406 179.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -82.87 142.98 31.07 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.055 -0.52 . . . . 12.95 111.217 -178.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.405 ' HA ' ' HA ' ' A' ' 96' ' ' GLN . 43.9 mt -87.27 113.5 24.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.191 -0.458 . . . . 11.11 110.274 179.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.409 ' H ' ' HG2' ' A' ' 104' ' ' GLU . 4.6 pt-20 -77.46 -41.76 38.45 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 121.069 -0.252 . . . . 11.65 110.415 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 29.4 p90 -163.82 175.15 10.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.697 0.285 . . . . 10.3 110.353 178.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 60.2 mt -118.4 121.88 68.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 116.283 -0.417 . . . . 10.29 110.449 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.493 HG12 ' HG2' ' A' ' 15' ' ' ARG . 42.1 mt -90.26 107.65 18.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 109.704 -0.48 . . . . 8.99 109.704 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.584 ' HB3' HG23 ' A' ' 90' ' ' THR . 72.8 m -98.96 112.7 24.74 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.186 0.517 . . . . 9.83 111.017 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.811 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 7.7 m -83.02 90.87 7.07 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.769 -0.826 . . . . 10.84 108.769 178.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.479 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 6.3 m-20 -79.29 94.63 5.5 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.825 -0.625 . . . . 11.26 111.67 -178.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 6.5 m -104.05 113.77 27.54 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.835 -0.431 . . . . 11.22 109.835 178.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . 0.506 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 9.4 t-20 -68.46 135.19 51.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.151 0.501 . . . . 12.78 111.097 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.416 HG12 ' HG3' ' A' ' 114' ' ' LYS . 40.7 t -109.3 -51.62 6.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.667 -0.697 . . . . 14.64 109.999 179.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.571 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 44.4 mtpt . . . . . 0 C--O 1.253 1.262 0 CA-C-O 118.276 -0.868 . . . . 16.02 109.917 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 22.0 m . . . . . 0 N--CA 1.478 0.946 0 CA-C-O 120.857 0.361 . . . . 7.49 110.074 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -138.65 163.54 46.13 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.349 -0.387 . . . . 7.12 110.77 -178.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_exo -69.48 167.59 23.62 Favored 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.895 2.396 . . . . 6.18 112.023 179.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . 0.611 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.0 OUTLIER -83.17 58.49 4.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.235 0.54 . . . . 5.81 111.145 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.669 ' HA ' ' O ' ' B' ' 110' ' ' ASN . 22.6 tt0 -162.09 129.05 3.79 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.496 -0.775 . . . . 5.85 109.443 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -138.55 154.69 48.75 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.199 0.523 . . . . 6.08 111.661 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.649 ' HB ' ' HB2' ' B' ' 26' ' ' ASP . 10.5 mm -88.35 120.43 37.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.54 -0.755 . . . . 5.57 110.664 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.71 ' HB3' ' HE2' ' B' ' 22' ' ' PHE . 0.7 OUTLIER -108.58 93.71 4.67 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.776 -0.647 . . . . 5.3 110.374 179.723 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . 0.625 ' HD3' ' HB3' ' B' ' 24' ' ' PHE . 11.2 mtp85 -85.72 108.65 18.15 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.375 -0.602 . . . . 8.97 109.375 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . 0.483 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 30.3 p80 -141.44 166.03 25.88 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.44 -0.345 . . . . 8.31 111.14 -179.152 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 12.0 p-10 -79.36 -177.76 5.9 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.235 -0.439 . . . . 10.83 110.469 179.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . 0.458 HG13 ' N ' ' B' ' 19' ' ' GLU . 9.8 pt -59.1 -35.02 55.09 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.378 0 N-CA-C 112.459 0.54 . . . . 8.89 112.459 -178.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . 0.458 ' N ' HG13 ' B' ' 18' ' ' ILE . 18.2 mt-10 -71.87 -28.3 63.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.018 0.437 . . . . 11.92 111.29 -179.371 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 117.44 -1.91 18.43 Favored Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 120.428 -0.892 . . . . 8.57 113.168 179.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . 0.458 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 36.9 mm -66.29 111.17 1.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 110.03 -0.359 . . . . 10.87 110.03 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . 0.71 ' HE2' ' HB3' ' B' ' 14' ' ' SER . 95.5 m-85 -66.85 130.92 44.72 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.175 -0.466 . . . . 8.23 110.941 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 1.1 m -108.6 -27.55 9.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.923 -0.581 . . . . 7.91 110.64 179.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . 0.625 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 15.7 t80 -160.21 137.19 9.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.014 -0.539 . . . . 7.89 109.97 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 10.9 t -125.69 146.06 32.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.429 -0.35 . . . . 6.1 110.811 -179.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . 0.649 ' HB2' ' HB ' ' B' ' 13' ' ' ILE . 5.8 t0 -71.16 161.89 30.35 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.463 -0.569 . . . . 7.15 109.463 179.036 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 17.1 m170 -80.26 37.03 0.37 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.811 0.339 . . . . 8.97 111.251 -179.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . 0.508 ' HD2' ' O ' ' B' ' 11' ' ' GLU . 29.0 mtm180 -128.39 3.07 5.66 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.887 0.375 . . . . 9.76 111.114 -179.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 1.8 p -62.74 -46.77 86.51 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 112.413 0.523 . . . . 11.56 112.413 -178.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 6.7 t -67.54 -26.48 35.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 121.079 0.466 . . . . 13.64 111.038 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.87 -22.13 43.24 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.217 -0.447 . . . . 12.9 111.108 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 13.0 m -92.57 -59.7 2.01 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.29 0.478 . . . . 12.13 112.29 -178.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' VAL . . . . . 0.561 HG12 HD21 ' B' ' 86' ' ' LEU . 3.2 m -118.63 -5.53 11.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 112.195 0.442 . . . . 13.87 112.195 -178.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 81.3 20.34 64.76 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.536 -0.84 . . . . 13.79 112.21 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' TYR . . . . . 0.455 ' HD1' ' HA ' ' B' ' 35' ' ' TYR . 1.0 OUTLIER -93.0 130.72 38.47 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.675 0.274 . . . . 15.38 110.909 -179.726 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -75.0 144.86 80.13 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 109.111 -0.7 . . . . 13.78 109.111 178.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.442 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 52.2 Cg_exo -54.52 -32.99 76.42 Favored 'Trans proline' 0 CA--C 1.529 0.233 0 C-N-CA 122.459 2.106 . . . . 14.71 112.23 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' GLN . . . . . 0.566 ' HA ' HD12 ' B' ' 41' ' ' LEU . 26.9 mp0 -75.52 -17.11 60.18 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.615 -0.721 . . . . 17.54 111.971 -179.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -75.54 -40.26 57.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.96 0.409 . . . . 14.24 110.574 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.524 ' HB3' ' CG ' ' B' ' 22' ' ' PHE . 1.9 mm? -74.84 -26.02 59.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.836 -0.62 . . . . 14.03 111.201 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.566 HD12 ' HA ' ' B' ' 38' ' ' GLN . 75.3 mt -61.48 119.8 9.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.083 -0.508 . . . . 13.62 111.469 -179.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 83.6 11.72 79.32 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.834 -0.698 . . . . 11.62 113.055 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.591 ' HE2' ' HA ' ' B' ' 43' ' ' LYS . 8.6 mmpt? -121.88 158.58 28.67 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.754 0.311 . . . . 13.82 110.479 179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' ASN . . . . . 0.56 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 12.4 m120 -94.16 139.94 30.37 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.055 -0.52 . . . . 10.16 109.84 179.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 19.6 tt -62.08 -24.48 34.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 120.996 0.427 . . . . 9.62 111.378 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 6.3 p -71.88 -18.29 19.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.172 -0.467 . . . . 11.5 111.217 -179.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . 0.56 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 38.1 mt-10 -75.81 -23.15 55.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.995 0.426 . . . . 11.89 111.031 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -110.09 22.05 16.05 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.023 -0.535 . . . . 13.6 110.092 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 51.4 t -110.6 150.87 28.34 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.682 -0.69 . . . . 10.81 110.451 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -59.64 126.24 82.19 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 115.807 -0.633 . . . . 11.49 109.576 179.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' PRO . . . . . 0.407 ' HA ' ' OE1' ' B' ' 54' ' ' GLN . 81.9 Cg_exo -47.29 -42.21 27.55 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.058 2.505 . . . . 11.35 113.58 -179.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 9.1 mp0 -78.45 0.32 26.31 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 112.334 0.494 . . . . 9.28 112.334 -179.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -129.83 5.05 5.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.888 0.375 . . . . 7.52 110.933 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . 0.407 ' OE1' ' HA ' ' B' ' 51' ' ' PRO . 70.8 mt-30 -63.75 -43.46 96.41 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.104 -0.498 . . . . 6.57 110.719 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 49.6 tp60 -63.63 -39.63 94.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.956 -0.566 . . . . 6.58 109.535 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.2 tp -57.78 -42.42 84.08 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.986 -0.552 . . . . 4.6 110.498 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.439 HD23 ' HA ' ' B' ' 57' ' ' LEU . 0.5 OUTLIER -63.72 -51.76 63.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.138 -0.483 . . . . 6.4 110.269 179.489 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . 0.404 ' O ' ' HG2' ' B' ' 62' ' ' GLN . 70.8 ttt180 -58.79 -44.29 90.68 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.82 -0.627 . . . . 8.18 110.878 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -59.25 -42.87 92.13 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.749 -0.66 . . . . 6.07 110.975 179.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 20.3 m -66.82 -34.02 76.9 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.867 -0.606 . . . . 5.59 110.592 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' PHE . . . . . 0.408 ' O ' HG12 ' B' ' 64' ' ' VAL . 9.5 m-85 -64.64 -37.87 89.05 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.104 0.478 . . . . 7.73 109.781 178.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' B' ' 58' ' ' ARG . 21.1 mm100 -63.99 -44.45 92.62 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.805 -0.634 . . . . 6.89 110.524 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -68.08 -40.44 82.68 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.615 -0.721 . . . . 9.4 111.776 -179.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.412 HG21 ' O ' ' B' ' 92' ' ' SER . 9.5 p -68.17 -28.57 41.39 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 C-N-CA 120.861 -0.336 . . . . 7.57 110.512 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . 0.411 ' HA ' HG21 ' B' ' 94' ' ' THR . 20.3 t -71.46 -37.25 63.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.01 -0.737 . . . . 7.43 109.01 178.113 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 18.3 mtpt -68.82 -37.52 79.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.527 -0.761 . . . . 10.21 110.278 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . . . . . . . . . 48.2 mt -62.02 -49.45 75.99 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 115.909 -0.587 . . . . 7.2 110.292 179.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 22.1 mttt 63.85 112.23 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 O-C-N 124.006 0.816 . . . . 7.58 112.46 179.133 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 77.18 23.07 69.46 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.851 -0.69 . . . . 5.57 112.72 178.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -129.8 166.16 20.48 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.818 0.342 . . . . 5.43 110.697 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' VAL . . . . . 0.642 ' HB ' ' HD1' ' B' ' 93' ' ' PHE . 2.8 p -116.19 120.34 64.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 CA-C-N 115.874 -0.603 . . . . 5.65 110.874 -179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 46.3 tp -107.22 119.5 39.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.914 -0.584 . . . . 4.51 109.96 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . 0.413 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 0.9 OUTLIER -89.38 111.73 22.66 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.97 -0.559 . . . . 6.35 110.781 -179.48 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.4 p -110.84 132.39 59.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 109.859 -0.423 . . . . 4.34 109.859 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 21.7 ttt -106.45 114.96 29.39 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.095 0.474 . . . . 5.42 110.972 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.546 ' HE2' ' HD1' ' B' ' 78' ' ' PHE . 49.6 p90 -144.96 -175.35 4.65 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.505 -0.771 . . . . 3.54 108.998 179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' ARG . . . . . 0.464 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 40.4 mtm180 -106.7 118.47 36.75 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.048 0.451 . . . . 6.8 110.497 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.546 ' HD1' ' HE2' ' B' ' 76' ' ' PHE . 14.8 t80 -97.13 145.66 25.8 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.297 -0.865 . . . . 5.79 110.201 -179.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' ARG . . . . . 0.532 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 22.4 ttp180 -85.8 129.72 34.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.3 -0.409 . . . . 11.08 110.676 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . 0.547 ' HA ' ' HB ' ' B' ' 33' ' ' VAL . 88.6 p -89.77 -177.83 5.35 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.704 -0.48 . . . . 7.47 109.704 178.628 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 51.6 tptt -68.47 -23.38 64.58 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.325 0.583 . . . . 12.24 109.547 178.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -86.13 4.66 37.35 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.631 -0.713 . . . . 9.25 110.349 178.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 67.07 29.23 8.04 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.45 -0.796 . . . . 8.3 111.469 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . 0.457 ' O ' ' HA ' ' B' ' 79' ' ' ARG . 1.7 pt-20 -95.88 152.91 18.07 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.153 -0.684 . . . . 6.78 109.153 178.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . 0.532 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 73.2 m95 -104.31 93.89 5.06 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.792 0.33 . . . . 7.89 110.384 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.561 HD21 HG12 ' B' ' 33' ' ' VAL . 1.8 pp -96.99 148.8 22.6 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.224 -0.444 . . . . 6.97 110.494 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 87' ' ' TRP . . . . . 0.497 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 90.5 m95 -72.82 121.99 20.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.965 0.412 . . . . 8.55 110.581 -179.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 27.2 tpp -122.47 131.62 53.95 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.782 -0.645 . . . . 4.46 110.981 -178.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 15.9 ttp180 -100.38 72.69 1.62 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.517 -0.92 . . . . 6.87 108.517 178.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 90' ' ' THR . . . . . 0.51 HG23 ' HB3' ' B' ' 108' ' ' CYS . 54.0 m -66.81 113.02 4.56 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.201 -0.908 . . . . 6.18 112.083 -178.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 91' ' ' SER . . . . . 0.413 ' HA ' ' HA ' ' B' ' 73' ' ' SER . 1.6 m -95.1 96.82 9.49 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.935 -0.765 . . . . 6.3 108.935 178.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . 0.467 ' O ' ' HA ' ' B' ' 71' ' ' VAL . 16.3 m -84.06 117.39 23.4 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.274 -0.421 . . . . 6.65 111.819 -178.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . 0.642 ' HD1' ' HB ' ' B' ' 71' ' ' VAL . 71.2 t80 -110.08 122.12 46.84 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.086 -0.506 . . . . 6.45 110.161 179.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . 0.411 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.7 OUTLIER -87.3 118.4 26.7 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.755 0.312 . . . . 9.17 111.01 179.796 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . 0.459 ' O ' ' HA ' ' B' ' 103' ' ' ILE . 0.0 OUTLIER -83.58 130.9 35.0 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.811 0.339 . . . . 8.33 110.919 -179.837 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -104.71 111.04 23.61 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.964 -0.562 . . . . 10.53 110.958 -179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 97' ' ' ASN . . . . . 0.478 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 65.3 t30 -74.32 127.3 87.93 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 109.513 -0.551 . . . . 8.43 109.513 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . 0.478 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 62.1 Cg_endo -74.71 20.02 0.45 Allowed 'Trans proline' 0 CA--C 1.535 0.554 0 C-N-CA 122.714 2.276 . . . . 9.16 113.884 -179.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -91.69 -56.72 3.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.938 0.399 . . . . 11.34 110.1 179.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 100' ' ' SER . . . . . 0.427 ' HB2' ' HG3' ' B' ' 102' ' ' GLU . 1.4 m -135.95 16.46 3.28 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.531 -0.544 . . . . 7.75 109.531 179.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 23.7 t70 63.84 40.26 7.68 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.232 -0.894 . . . . 9.08 110.497 -179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . 0.427 ' HG3' ' HB2' ' B' ' 100' ' ' SER . 0.0 OUTLIER -96.83 158.87 15.22 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.708 -0.678 . . . . 7.71 110.481 179.948 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' ILE . . . . . 0.459 ' HA ' ' O ' ' B' ' 95' ' ' PHE . 68.7 mt -95.44 105.05 16.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 109.709 -0.478 . . . . 8.04 109.709 179.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -60.59 -52.33 65.63 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.84 -0.618 . . . . 8.81 110.962 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -164.37 171.16 15.13 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.613 -0.721 . . . . 7.4 110.019 -179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 37.8 mt -108.47 119.54 58.23 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.952 -0.567 . . . . 6.78 109.951 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.408 ' HB ' ' HB3' ' B' ' 93' ' ' PHE . 33.5 mt -86.6 97.98 6.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 N-CA-C 109.443 -0.577 . . . . 6.31 109.443 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' CYS . . . . . 0.51 ' HB3' HG23 ' B' ' 90' ' ' THR . 92.5 m -92.68 104.38 16.66 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.178 0.436 . . . . 5.31 112.178 -179.103 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . 0.414 ' HA ' HD13 ' B' ' 13' ' ' ILE . 3.5 m -78.28 97.46 5.57 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.606 -0.887 . . . . 5.48 108.606 177.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' ASN . . . . . 0.669 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 5.2 m-20 -80.56 89.02 5.65 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.012 -0.54 . . . . 6.9 111.78 -178.118 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 3.3 m -94.78 112.55 24.28 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.199 -0.455 . . . . 8.61 110.496 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 112' ' ' ASN . . . . . 0.611 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 4.2 t-20 -70.49 131.66 44.37 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.068 0.461 . . . . 11.84 110.779 -179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 93.5 t -104.79 -55.94 5.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.591 -0.732 . . . . 11.77 109.986 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . 0.497 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 42.2 mtpt . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.197 -0.906 . . . . 12.68 109.937 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.9 m . . . . . 0 N--CA 1.477 0.895 0 N-CA-C 109.892 -0.41 . . . . 15.6 109.892 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 27.2 mm-40 -91.33 117.22 67.7 Favored Pre-proline 0 C--N 1.325 -0.479 0 N-CA-C 110.239 -0.282 . . . . 15.08 110.239 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.408 ' HG2' ' HD2' ' A' ' 28' ' ' ARG . 33.0 Cg_endo -65.75 154.32 74.38 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.572 2.181 . . . . 13.43 111.94 179.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.715 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.8 OUTLIER -77.35 43.25 0.37 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.229 0.538 . . . . 11.09 111.33 179.91 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.571 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 32.8 tt0 -145.75 126.48 14.33 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.852 -0.796 . . . . 10.59 108.852 -179.306 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.957 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 33.5 p90 -145.35 156.42 43.78 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.088 0.47 . . . . 8.93 111.342 -179.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.567 HG23 HG23 ' A' ' 107' ' ' ILE . 21.8 mm -85.31 117.13 29.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.681 -0.69 . . . . 8.66 110.995 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.434 ' HB3' ' HE1' ' A' ' 22' ' ' PHE . 0.8 OUTLIER -105.75 92.5 4.2 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.119 -0.492 . . . . 6.11 110.294 179.481 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 15' ' ' ARG . 6.4 mtt180 -81.48 117.59 22.03 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.482 -0.562 . . . . 9.09 109.482 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.1 p80 -149.16 159.28 44.38 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.921 -0.311 . . . . 9.79 111.041 -179.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.2 p-10 -80.76 178.06 8.62 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.308 -0.406 . . . . 12.69 110.349 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.9 pt -58.56 -28.07 35.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.432 0 N-CA-C 113.087 0.773 . . . . 13.58 113.087 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -75.06 -23.65 58.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.28 0.562 . . . . 13.85 110.878 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 112.84 -7.27 25.74 Favored Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 120.841 -0.695 . . . . 9.38 111.748 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.461 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 38.9 mm -66.88 115.19 4.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 N-CA-C 110.011 -0.366 . . . . 10.74 110.011 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.461 ' CZ ' ' HB ' ' A' ' 45' ' ' ILE . 98.0 m-85 -71.37 128.59 36.38 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.953 -0.567 . . . . 9.73 111.402 -179.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 23.4 p -95.04 -31.59 13.52 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.25 -0.886 . . . . 7.74 110.102 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -155.47 132.16 10.52 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.465 -0.789 . . . . 6.92 109.423 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.656 HG21 ' HB2' ' A' ' 40' ' ' LEU . 21.6 t -116.99 143.38 27.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.722 0.296 . . . . 6.02 110.972 -179.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.957 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 6.9 t70 -67.23 166.03 14.98 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.76 -0.654 . . . . 7.31 110.396 179.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 51.5 m170 -87.82 -13.28 42.58 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.928 0.395 . . . . 11.67 110.648 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.488 HH22 HG21 ' B' ' 107' ' ' ILE . 79.2 mtm180 -81.73 -1.96 48.93 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.227 -0.442 . . . . 11.91 112.033 -179.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 29.2 p -65.04 -30.45 71.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.945 0.402 . . . . 12.99 111.257 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.465 HG13 HE22 ' A' ' 36' ' ' GLN . 24.7 t -61.47 -39.72 83.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.838 -0.619 . . . . 16.15 111.665 -179.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.73 -18.19 33.76 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.703 0.287 . . . . 15.07 111.426 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.3 m -85.09 -53.3 5.36 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.344 -0.389 . . . . 14.9 111.917 -179.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.48 HG23 ' H ' ' A' ' 35' ' ' TYR . 3.7 m -123.5 -15.5 5.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.2 0.445 . . . . 13.84 112.2 -179.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 92.41 -13.82 66.28 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.439 -0.886 . . . . 13.85 111.833 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.48 ' H ' HG23 ' A' ' 33' ' ' VAL . 4.7 m-30 -71.46 133.04 45.6 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.679 -0.26 . . . . 18.28 110.58 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.497 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 37.3 mm-40 -78.25 150.77 77.65 Favored Pre-proline 0 C--N 1.321 -0.668 0 N-CA-C 108.445 -0.946 . . . . 15.48 108.445 178.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.616 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 74.5 Cg_exo -50.22 -43.17 44.43 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.468 2.112 . . . . 11.63 112.515 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 22.3 mp0 -63.49 -22.51 66.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.001 -0.545 . . . . 13.31 112.099 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.497 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 36.5 mt-10 -74.9 -22.54 58.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.852 0.358 . . . . 17.34 110.922 -179.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.656 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.9 mm? -98.14 -30.07 12.86 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.124 -0.489 . . . . 13.25 110.792 -179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 92.3 mt -62.77 108.28 1.14 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 12.99 111.217 -179.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 97.04 2.86 59.21 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.894 -0.67 . . . . 13.39 112.153 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.785 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 4.1 mmpt? -112.4 158.26 20.04 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 110.331 -0.248 . . . . 16.87 110.331 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.818 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 15.4 m120 -94.01 135.86 34.91 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.973 -0.38 . . . . 12.5 109.973 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.461 ' HB ' ' CZ ' ' A' ' 22' ' ' PHE . 13.8 tt -63.79 -27.34 42.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-O 121.014 0.435 . . . . 11.72 110.501 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 6.1 p -68.5 -17.72 22.47 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 CA-C-N 116.086 -0.507 . . . . 12.89 111.392 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.818 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 34.9 mt-10 -78.49 -35.04 47.06 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.939 0.4 . . . . 16.53 111.143 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.459 ' HE2' ' HB3' ' A' ' 43' ' ' LYS . 48.8 m-85 -95.46 6.44 48.97 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.183 0.516 . . . . 15.34 110.752 -179.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 48.9 t -93.75 154.66 17.65 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.807 -0.633 . . . . 11.97 110.343 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.527 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 3.7 t-160 -62.43 128.44 91.37 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.647 -0.706 . . . . 14.67 109.512 179.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -44.6 -50.47 8.18 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 123.195 2.597 . . . . 15.15 114.25 -179.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -73.1 -11.56 60.59 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.794 0.294 . . . . 16.47 111.794 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.527 ' HB2' ' HB3' ' A' ' 50' ' ' HIS . 5.5 m-20 -107.29 -0.16 22.71 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.863 0.363 . . . . 13.16 110.881 -179.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -60.89 -50.21 74.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.046 -0.524 . . . . 15.83 111.17 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -64.38 -36.05 82.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.786 0.327 . . . . 13.94 110.24 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 29.7 tp -58.1 -45.41 87.27 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.2 0.524 . . . . 12.11 109.744 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.429 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.4 OUTLIER -68.12 -47.23 68.7 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.481 -0.781 . . . . 9.71 109.984 179.041 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 36.9 ttt180 -54.26 -47.22 72.52 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.213 -0.903 . . . . 11.06 111.279 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -64.61 -43.86 92.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.133 -0.485 . . . . 9.71 110.924 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.7 m -60.04 -35.28 74.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.342 -0.39 . . . . 9.52 110.645 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.543 ' O ' HG12 ' A' ' 64' ' ' VAL . 7.4 m-85 -65.28 -46.09 81.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.321 -0.4 . . . . 11.4 110.19 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -66.27 -34.97 79.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.195 0.522 . . . . 10.04 109.944 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 11.6 mt-30 -63.87 -40.67 97.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.667 -0.697 . . . . 10.6 110.61 179.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.543 HG12 ' O ' ' A' ' 61' ' ' PHE . 0.4 OUTLIER -70.02 -25.63 28.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 116.564 -0.289 . . . . 10.62 110.872 -179.731 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 61' ' ' PHE . 75.5 t -69.03 -37.79 77.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 N-CA-C 109.026 -0.731 . . . . 12.41 109.026 178.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 48.5 mtpt -76.5 -28.52 56.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.252 -0.886 . . . . 16.25 110.242 179.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.641 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 58.3 mt -71.71 -56.74 5.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.176 -0.466 . . . . 12.66 110.79 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.417 ' HG3' ' O ' ' A' ' 65' ' ' VAL . 78.7 mttt 62.47 104.96 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 O-C-N 123.727 0.642 . . . . 14.83 112.315 179.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.04 -4.03 86.58 Favored Glycine 0 N--CA 1.454 -0.16 0 C-N-CA 120.716 -0.754 . . . . 9.8 112.942 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.641 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 7.1 tp-100 -101.53 130.31 47.78 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.67 -0.493 . . . . 9.59 109.67 179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 2.7 p -83.29 107.26 14.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.288 0.566 . . . . 8.1 110.251 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 20.1 tp -100.08 110.98 23.28 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.996 -0.547 . . . . 7.8 110.312 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.441 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 0.0 OUTLIER -89.23 108.6 19.71 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.998 -0.546 . . . . 7.59 111.096 -179.612 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.428 HG13 ' HB ' ' A' ' 90' ' ' THR . 2.3 p -100.36 125.35 54.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.13 -0.486 . . . . 7.84 109.758 178.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 23.0 ttt -100.52 106.87 18.45 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.341 -0.391 . . . . 9.35 110.349 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.503 ' HE2' ' HD1' ' A' ' 78' ' ' PHE . 46.0 p90 -134.25 -174.47 3.56 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.815 -0.63 . . . . 9.66 110.159 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.491 ' HB2' ' HB2' ' A' ' 50' ' ' HIS . 47.4 mtt180 -105.08 117.14 33.25 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.184 -0.462 . . . . 13.1 110.195 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.503 ' HD1' ' HE2' ' A' ' 76' ' ' PHE . 11.4 t80 -107.03 147.6 29.74 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.019 -0.537 . . . . 9.28 109.888 -179.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.535 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 35.2 ttp180 -87.9 136.47 32.95 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.852 0.358 . . . . 10.87 110.885 179.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.417 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 66.0 p -96.52 -174.39 3.02 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.103 -0.499 . . . . 10.77 109.999 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.446 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 42.1 tptt -70.65 -14.25 62.4 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.346 0.593 . . . . 12.66 109.841 178.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -92.6 3.1 56.2 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.782 -0.644 . . . . 14.42 109.624 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 67.4 20.7 9.88 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.4 -0.818 . . . . 12.69 111.172 -179.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.417 ' HG2' ' OG ' ' A' ' 80' ' ' SER . 3.2 pt-20 -96.07 153.47 17.76 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.357 -0.608 . . . . 10.85 109.357 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.535 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 67.1 m95 -100.29 112.17 24.49 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.892 0.377 . . . . 11.2 110.676 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.446 HD13 HD22 ' A' ' 112' ' ' ASN . 1.5 pp -110.02 156.04 21.04 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.241 -0.436 . . . . 11.12 110.643 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.513 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 82.5 m95 -81.67 114.65 20.48 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.197 0.523 . . . . 10.28 110.786 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 38.1 tpp -114.92 131.54 56.84 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.435 -0.802 . . . . 9.32 110.886 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.6 ttp180 -101.52 76.84 1.71 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.838 -0.801 . . . . 10.66 108.838 178.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.72 HG23 ' HB3' ' A' ' 108' ' ' CYS . 36.7 m -67.33 109.58 3.2 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.381 -0.827 . . . . 9.37 112.066 -178.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.441 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 0.7 OUTLIER -90.25 88.8 7.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.265 -0.879 . . . . 8.27 109.442 179.506 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.1 m -74.07 131.27 41.17 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.95 -0.568 . . . . 8.65 111.897 -178.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -130.3 122.43 27.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.878 -0.601 . . . . 11.56 110.176 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.26 119.24 18.2 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.402 -0.363 . . . . 10.16 111.388 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -101.52 106.97 18.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.942 0.401 . . . . 12.25 109.997 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -104.01 152.02 22.53 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.086 -0.506 . . . . 14.24 111.335 -179.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.439 ' HB3' ' OE1' ' A' ' 102' ' ' GLU . 11.4 t-20 -86.3 133.03 41.4 Favored Pre-proline 0 C--N 1.322 -0.627 0 N-CA-C 108.79 -0.818 . . . . 13.83 108.79 178.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.62 14.4 0.41 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 122.81 2.34 . . . . 15.34 113.898 -178.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -87.29 -54.72 4.15 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.883 0.373 . . . . 16.89 110.294 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 18.8 m -142.38 19.91 2.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.142 -0.481 . . . . 14.89 110.179 178.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 18.4 t70 67.93 32.15 5.28 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.703 -0.681 . . . . 14.77 110.561 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.439 ' OE1' ' HB3' ' A' ' 97' ' ' ASN . 1.6 mp0 -76.5 122.6 24.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.014 -0.539 . . . . 12.95 110.089 -179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 50.9 mt -70.57 108.56 2.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 109.993 -0.373 . . . . 11.11 109.993 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -72.78 -54.32 9.21 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.057 -0.52 . . . . 11.65 110.281 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 19.5 p90 -162.4 179.67 7.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.667 -0.697 . . . . 10.3 110.066 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 56.5 mt -115.64 117.89 57.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.222 -0.445 . . . . 10.29 110.468 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.604 HG21 HH22 ' B' ' 15' ' ' ARG . 33.4 mt -89.5 102.91 13.57 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.51 -0.552 . . . . 8.99 109.51 179.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.72 ' HB3' HG23 ' A' ' 90' ' ' THR . 99.5 m -97.15 112.69 24.36 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.227 0.537 . . . . 9.83 111.828 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.482 HG21 HG21 ' B' ' 13' ' ' ILE . 1.6 m -80.66 98.14 7.56 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 108.652 -0.87 . . . . 10.84 108.652 178.211 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.571 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 4.5 m-20 -80.55 99.84 8.29 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.148 -0.478 . . . . 11.26 111.544 -178.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.439 HG23 ' HB2' ' A' ' 11' ' ' GLU . 3.1 m -106.22 109.74 21.77 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.863 -0.608 . . . . 11.22 109.976 178.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . 0.715 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 5.0 t-20 -75.19 134.88 41.1 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.881 0.372 . . . . 12.78 110.719 -179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.581 HG12 ' HG3' ' A' ' 114' ' ' LYS . 76.8 t -111.34 -50.55 6.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.91 -0.586 . . . . 14.64 109.9 179.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.581 ' HG3' HG12 ' A' ' 113' ' ' VAL . 61.3 mtpt . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.142 -0.932 . . . . 16.02 110.024 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 41.9 m . . . . . 0 N--CA 1.479 0.996 0 CA-C-O 121.05 0.453 . . . . 7.49 109.922 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' GLN . . . . . 0.468 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 26.4 mm-40 -124.88 135.94 27.38 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.287 -0.415 . . . . 7.12 110.604 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . 0.466 ' HD2' ' HG2' ' B' ' 28' ' ' ARG . 37.6 Cg_exo -61.06 154.8 54.49 Favored 'Trans proline' 0 CA--C 1.53 0.306 0 C-N-CA 122.763 2.308 . . . . 6.18 112.309 179.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.33 46.57 1.05 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.494 0.664 . . . . 5.81 110.654 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.635 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 62.3 tt0 -155.68 115.52 3.67 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.168 -0.923 . . . . 5.85 108.584 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' PHE . . . . . 0.654 ' HB3' ' HB2' ' B' ' 28' ' ' ARG . 33.9 p90 -137.23 155.99 48.84 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.505 0.557 . . . . 6.08 112.505 -178.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.495 HG13 HG23 ' B' ' 107' ' ' ILE . 3.4 tt -84.8 118.94 32.78 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.42 -0.809 . . . . 5.57 110.741 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -105.76 100.87 10.41 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.042 -0.527 . . . . 5.3 110.008 179.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . 0.604 HH22 HG21 ' A' ' 107' ' ' ILE . 9.4 mtp180 -88.88 105.1 17.52 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.882 -0.414 . . . . 8.97 109.882 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . . . . . . . . . 34.5 p80 -131.71 155.94 46.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.952 -0.567 . . . . 8.31 110.217 -179.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -74.58 173.42 10.44 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.62 -0.264 . . . . 10.83 110.406 179.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 13.5 pt -56.78 -31.15 34.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 N-CA-C 112.846 0.684 . . . . 8.89 112.846 -178.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -71.15 -27.52 63.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.021 0.439 . . . . 11.92 111.254 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 117.82 -2.97 17.35 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.565 -0.826 . . . . 8.57 112.664 179.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . 0.406 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 19.3 mm -75.31 123.51 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 110.152 -0.314 . . . . 10.87 110.152 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . 0.542 ' CZ ' ' HB ' ' B' ' 45' ' ' ILE . 97.2 m-85 -74.74 130.65 39.87 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.877 0.37 . . . . 8.23 111.254 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 19.4 m -102.38 -39.95 6.94 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.982 -0.554 . . . . 7.91 110.309 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . 0.439 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 44.0 t80 -152.12 134.03 14.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.945 -0.57 . . . . 7.89 109.897 179.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 2.0 m -131.56 156.66 42.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.539 -0.301 . . . . 6.1 110.589 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . 0.555 ' HB3' ' HB2' ' B' ' 12' ' ' PHE . 11.8 t70 -81.95 158.98 23.7 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.04 -0.527 . . . . 7.15 110.466 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 29.7 m80 -67.92 -17.7 64.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.306 -0.406 . . . . 8.97 111.475 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . 0.654 ' HB2' ' HB3' ' B' ' 12' ' ' PHE . 65.5 mtm180 -62.98 -16.82 60.96 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 116.255 -0.429 . . . . 9.76 111.858 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 29.3 p -60.21 -36.3 77.36 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.749 0.309 . . . . 11.56 111.654 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.477 ' O ' ' HA2' ' B' ' 34' ' ' GLY . 47.3 t -63.25 -31.42 52.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.972 -0.558 . . . . 13.64 111.34 -179.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -91.16 -21.09 21.34 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.809 0.338 . . . . 12.9 111.308 -179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 26.0 m -82.92 -57.05 3.46 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.066 0.395 . . . . 12.13 112.066 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' VAL . . . . . 0.553 HG11 ' HD2' ' B' ' 78' ' ' PHE . 0.2 OUTLIER -117.31 -11.68 11.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 N-CA-C 111.83 0.307 . . . . 13.87 111.83 -179.391 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' GLY . . . . . 0.477 ' HA2' ' O ' ' B' ' 30' ' ' VAL . . . 90.01 -0.82 79.57 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.506 -0.854 . . . . 13.79 112.364 179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 -79.57 132.51 36.31 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.654 0.264 . . . . 15.38 111.033 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . 0.456 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 80.8 mm-40 -76.6 147.12 77.96 Favored Pre-proline 0 C--N 1.321 -0.674 0 N-CA-C 107.993 -1.114 . . . . 13.78 107.993 177.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.632 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 72.5 Cg_exo -49.86 -39.93 48.66 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.561 2.174 . . . . 14.71 112.878 -179.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -66.93 -17.03 64.72 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.914 -0.584 . . . . 17.54 112.531 -179.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.456 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 33.2 mt-10 -78.74 -32.21 46.62 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.885 0.374 . . . . 14.24 110.648 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' B' ' 22' ' ' PHE . 1.8 mm? -82.88 -30.7 28.34 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.067 -0.515 . . . . 14.03 110.985 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.632 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 58.8 mt -61.7 104.8 0.47 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.253 -0.43 . . . . 13.62 111.668 -179.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 100.69 5.81 53.38 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.85 -0.69 . . . . 11.62 112.85 179.377 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.666 ' HE2' ' HA ' ' B' ' 43' ' ' LYS . 6.1 mmpt? -118.85 157.31 27.86 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.612 0.244 . . . . 13.82 110.68 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' ASN . . . . . 0.791 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 18.8 m120 -93.4 137.1 33.03 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.235 -0.438 . . . . 10.16 110.177 179.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . 0.542 ' HB ' ' CZ ' ' B' ' 22' ' ' PHE . 14.1 tt -59.69 -29.42 42.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 121.143 0.497 . . . . 9.62 110.952 179.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' VAL . . . . . 0.422 HG12 ' HB3' ' B' ' 44' ' ' ASN . 7.9 p -69.63 -20.91 24.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.991 -0.549 . . . . 11.5 111.401 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . 0.791 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 38.6 mt-10 -74.15 -20.78 60.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.926 0.393 . . . . 11.89 110.935 -179.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' PHE . . . . . 0.407 ' HB2' ' CZ ' ' B' ' 78' ' ' PHE . 40.6 m-85 -112.04 18.87 18.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.101 0.477 . . . . 13.6 109.906 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 51.9 t -102.88 151.62 22.23 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.818 -0.628 . . . . 10.81 110.636 -179.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' HIS . . . . . 0.611 ' HB3' ' HB2' ' B' ' 53' ' ' ASP . 5.0 t-80 -57.36 130.22 80.56 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.835 -0.62 . . . . 11.49 109.472 178.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -46.49 -45.77 18.66 Favored 'Trans proline' 0 CA--C 1.534 0.481 0 C-N-CA 123.048 2.499 . . . . 11.35 113.587 -179.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -82.34 6.55 16.66 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.138 0.421 . . . . 9.28 112.138 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . 0.611 ' HB2' ' HB3' ' B' ' 50' ' ' HIS . 5.2 m-20 -125.1 -0.7 7.78 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.033 0.444 . . . . 7.52 110.498 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -64.4 -46.88 81.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.835 -0.62 . . . . 6.57 111.102 -179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 49.2 tp60 -61.51 -42.16 98.38 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.108 -0.497 . . . . 6.58 110.402 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 65.4 tp -59.44 -42.09 91.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.081 -0.509 . . . . 4.6 110.28 179.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.41 HD22 ' CZ ' ' B' ' 61' ' ' PHE . 0.5 OUTLIER -62.87 -49.95 72.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.089 -0.505 . . . . 6.4 110.043 179.356 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 77.4 ttt180 -58.18 -46.04 86.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.435 -0.802 . . . . 8.18 111.239 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -62.7 -38.69 91.43 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.095 -0.502 . . . . 6.07 111.197 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 31.0 m -68.74 -36.79 78.84 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.149 -0.478 . . . . 5.59 110.982 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' PHE . . . . . 0.593 ' O ' HG12 ' B' ' 64' ' ' VAL . 8.2 m-85 -62.51 -46.46 88.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.759 0.314 . . . . 7.73 110.738 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -67.04 -27.69 67.6 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.933 0.397 . . . . 6.89 110.555 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.543 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 18.2 mt-30 -72.53 -42.06 65.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.048 -0.524 . . . . 9.4 110.933 179.575 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.593 HG12 ' O ' ' B' ' 61' ' ' PHE . 3.2 p -66.04 -25.13 35.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.802 0.334 . . . . 7.57 110.31 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . 0.5 HG23 ' O ' ' B' ' 61' ' ' PHE . 89.3 t -72.22 -32.56 43.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 109.264 -0.643 . . . . 7.43 109.264 178.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -71.84 -34.72 69.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.65 -0.704 . . . . 10.21 110.182 179.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' B' ' 63' ' ' GLN . 24.3 mt -68.94 -51.18 42.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.772 -0.649 . . . . 7.2 109.975 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 31.1 mttt 59.44 102.31 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 O-C-N 124.12 0.887 . . . . 7.58 112.383 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.63 16.61 54.62 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.649 -0.786 . . . . 5.57 112.328 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -126.45 162.16 26.25 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 110.275 -0.269 . . . . 5.43 110.275 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' VAL . . . . . 0.4 ' HA ' ' O ' ' B' ' 92' ' ' SER . 24.8 t -106.88 121.09 59.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.342 -0.39 . . . . 5.65 111.125 -179.017 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 21.2 tp -115.81 104.09 11.3 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.216 -0.661 . . . . 4.51 109.216 178.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . 0.476 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 1.4 m -86.21 117.97 25.37 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.908 -0.587 . . . . 6.35 111.032 -179.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.7 p -103.86 129.05 56.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 116.024 -0.534 . . . . 4.34 110.21 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 10.7 tpt -100.47 117.1 33.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.124 -0.489 . . . . 5.42 110.362 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 43.0 p90 -154.31 -171.91 4.03 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.393 -0.367 . . . . 3.54 110.205 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' ARG . . . . . 0.597 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 11.8 mtm180 -108.59 119.33 39.19 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.961 0.41 . . . . 6.8 110.62 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.553 ' HD2' HG11 ' B' ' 33' ' ' VAL . 19.5 t80 -102.38 144.78 30.43 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.482 -0.781 . . . . 5.79 110.03 -179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' ARG . . . . . 0.562 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 35.7 ttp180 -80.34 136.54 36.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.725 0.298 . . . . 11.08 110.517 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . 0.556 ' OG ' ' HG2' ' B' ' 84' ' ' GLU . 88.9 p -99.26 -176.34 3.27 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.866 -0.42 . . . . 7.47 109.866 178.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . 0.425 ' HA ' ' HD2' ' B' ' 81' ' ' LYS . 32.2 tptt -70.19 -10.42 58.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.566 0.698 . . . . 12.24 109.688 178.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 33.2 m-20 -96.39 3.49 52.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.416 -0.811 . . . . 9.25 109.796 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 67.49 17.5 10.04 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.511 -0.768 . . . . 8.3 111.327 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . 0.556 ' HG2' ' OG ' ' B' ' 80' ' ' SER . 7.1 pt-20 -94.91 158.94 15.26 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.236 -0.653 . . . . 6.78 109.236 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . 0.597 ' HB3' ' HB3' ' B' ' 77' ' ' ARG . 42.2 m95 -106.48 108.65 20.27 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 121.03 -0.268 . . . . 7.89 110.631 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.46 ' O ' ' HA ' ' B' ' 77' ' ' ARG . 1.9 pp -105.57 152.68 22.77 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.345 -0.388 . . . . 6.97 110.129 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 87' ' ' TRP . . . . . 0.79 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 95.1 m95 -80.88 120.32 24.56 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.034 0.445 . . . . 8.55 110.835 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 2.0 ttp -132.0 140.48 48.95 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.929 -0.578 . . . . 4.46 110.889 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 28.5 ttp180 -103.01 93.89 5.26 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.776 -0.647 . . . . 6.87 109.36 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 90' ' ' THR . . . . . 0.545 ' CG2' ' HB3' ' B' ' 108' ' ' CYS . 6.4 m -78.47 105.37 9.69 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.014 -0.539 . . . . 6.18 111.281 -179.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 91' ' ' SER . . . . . 0.476 ' HA ' ' HA ' ' B' ' 73' ' ' SER . 0.9 OUTLIER -84.05 94.86 8.41 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.65 -0.704 . . . . 6.3 109.973 179.657 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . 0.4 ' O ' ' HA ' ' B' ' 71' ' ' VAL . 8.6 m -84.73 127.18 33.98 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.366 -0.379 . . . . 6.65 111.939 -178.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 83.4 t80 -125.24 131.0 53.2 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.21 -0.45 . . . . 6.45 109.904 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . 0.446 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.0 OUTLIER -89.28 114.36 25.72 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.472 -0.331 . . . . 9.17 110.797 179.644 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -102.45 122.81 45.05 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.917 0.389 . . . . 8.33 110.423 179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -106.6 147.65 29.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.968 -0.56 . . . . 10.53 110.533 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 97' ' ' ASN . . . . . 0.432 ' HB3' ' CD2' ' B' ' 99' ' ' TYR . 3.4 m-80 -85.11 147.25 47.26 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 115.972 -0.558 . . . . 8.43 110.221 179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -78.61 49.83 3.21 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.8 2.333 . . . . 9.16 112.999 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . 0.432 ' CD2' ' HB3' ' B' ' 97' ' ' ASN . 51.3 m-85 -128.71 -58.14 1.17 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.999 0.428 . . . . 11.34 110.366 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -138.13 21.01 2.8 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.191 -0.459 . . . . 7.75 110.538 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 32.7 t70 62.83 32.76 15.7 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.779 0.8 . . . . 9.08 110.005 -179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -85.7 140.42 30.54 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.481 -0.781 . . . . 7.71 110.783 -179.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 25.5 mt -84.94 117.74 30.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 116.322 -0.399 . . . . 8.04 110.028 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -75.7 -46.37 31.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.909 0.385 . . . . 8.81 110.045 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -165.49 172.48 12.05 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.796 -0.638 . . . . 7.4 109.643 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 54.3 mt -106.37 115.89 48.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 109.952 -0.388 . . . . 6.78 109.952 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.495 HG23 HG13 ' B' ' 13' ' ' ILE . 77.0 mt -81.9 105.55 11.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.753 -0.658 . . . . 6.31 109.741 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' CYS . . . . . 0.545 ' HB3' ' CG2' ' B' ' 90' ' ' THR . 94.4 m -107.85 99.0 8.51 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 120.863 0.363 . . . . 5.31 111.948 -179.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 94.4 m -75.64 105.54 6.73 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.413 -0.958 . . . . 5.48 108.413 177.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' ASN . . . . . 0.634 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 3.7 m-20 -81.85 101.18 10.03 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.718 -0.674 . . . . 6.9 111.671 -178.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 20.4 m -101.56 107.43 18.71 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.814 -0.63 . . . . 8.61 110.301 179.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 112' ' ' ASN . . . . . 0.424 HD22 HD13 ' B' ' 86' ' ' LEU . 8.9 t-20 -70.86 135.76 48.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.787 0.327 . . . . 11.84 110.502 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 37.1 t -113.37 -53.46 5.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.005 -0.543 . . . . 11.77 110.009 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . 0.79 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 46.4 mtpt . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.283 -0.865 . . . . 12.68 109.817 179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 95.0 m . . . . . 0 N--CA 1.476 0.842 0 N-CA-C 110.011 -0.366 . . . . 15.6 110.011 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 78.6 mm-40 -109.06 109.0 60.89 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 109.582 -0.525 . . . . 15.08 109.582 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -61.12 150.83 82.5 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 123.089 2.526 . . . . 13.43 112.32 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.812 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.0 OUTLIER -82.96 51.39 1.92 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.27 0.557 . . . . 11.09 110.8 -179.861 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.632 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 30.7 tt0 -153.71 116.26 4.42 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.602 -0.888 . . . . 10.59 108.602 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.998 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 41.3 p90 -130.95 166.39 21.07 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.984 0.421 . . . . 8.93 111.579 -178.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.559 HD13 HG23 ' A' ' 109' ' ' THR . 30.9 mm -94.77 121.28 45.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.854 -0.612 . . . . 8.66 110.665 -179.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.626 ' HB3' ' HE2' ' A' ' 22' ' ' PHE . 0.7 OUTLIER -106.54 97.1 6.93 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.159 -0.473 . . . . 6.11 110.878 179.588 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.439 ' HB2' ' HB3' ' A' ' 24' ' ' PHE . 3.5 mtt180 -83.17 102.41 11.85 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.763 -0.829 . . . . 9.09 108.763 178.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.446 ' O ' ' HB2' ' A' ' 105' ' ' TYR . 34.4 p80 -132.18 158.7 41.03 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 121.149 -0.22 . . . . 9.79 111.265 -178.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -77.92 178.23 7.61 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.487 -0.324 . . . . 12.69 110.235 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 22.2 pt -54.55 -37.04 37.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 113.374 0.879 . . . . 13.58 113.374 -178.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -73.17 -25.66 60.88 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.039 0.447 . . . . 13.85 111.568 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 116.35 1.09 20.39 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.449 -0.882 . . . . 9.38 112.198 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.434 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 37.0 mm -67.89 114.37 4.67 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 109.728 -0.471 . . . . 10.74 109.728 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.626 ' HE2' ' HB3' ' A' ' 14' ' ' SER . 78.8 m-85 -67.32 126.27 28.72 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.143 -0.48 . . . . 9.73 110.907 -179.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 1.2 m -106.29 -26.02 11.7 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.68 -0.691 . . . . 7.74 109.754 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.46 ' HE2' ' HE1' ' B' ' 95' ' ' PHE . 78.1 t80 -152.42 116.2 4.83 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.646 -0.706 . . . . 6.92 109.615 179.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.604 HG21 ' HB2' ' A' ' 40' ' ' LEU . 19.3 t -112.27 127.48 69.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 116.347 -0.388 . . . . 6.02 110.763 -179.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.998 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 10.1 t70 -66.38 136.28 55.54 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.145 -0.48 . . . . 7.31 110.08 179.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 22.6 p80 -57.61 -16.3 9.99 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.896 0.702 . . . . 11.67 112.896 -179.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.472 ' HB2' ' HB3' ' A' ' 12' ' ' PHE . 80.1 mtm180 -67.95 -10.57 54.51 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 122.216 -0.302 . . . . 11.91 111.077 179.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 29.1 p -59.89 -31.46 69.82 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.726 0.298 . . . . 12.99 110.914 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 20.4 t -65.01 -36.55 78.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.185 -0.461 . . . . 16.15 110.823 -179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -86.05 -16.27 38.67 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.933 0.397 . . . . 15.07 110.922 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.79 ' HA ' HG22 ' A' ' 10' ' ' THR . 25.8 m -87.97 -56.64 3.25 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.019 -0.537 . . . . 14.9 111.594 -179.579 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.65 ' HB ' ' HA ' ' A' ' 80' ' ' SER . 7.7 m -121.47 -19.41 4.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 111.924 0.342 . . . . 13.84 111.924 -179.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.2 -18.27 56.82 Favored Glycine 0 N--CA 1.454 -0.145 0 C-N-CA 120.602 -0.809 . . . . 13.85 112.273 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.461 ' H ' HG23 ' A' ' 33' ' ' VAL . 5.7 m-85 -66.37 136.92 56.46 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.624 0.249 . . . . 18.28 110.483 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.481 ' HB2' ' HG3' ' A' ' 39' ' ' GLU . 33.6 mm-40 -76.24 150.6 83.01 Favored Pre-proline 0 C--N 1.326 -0.437 0 N-CA-C 109.37 -0.604 . . . . 15.48 109.37 179.207 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.537 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 52.6 Cg_exo -52.47 -41.97 64.27 Favored 'Trans proline' 0 CA--C 1.527 0.162 0 C-N-CA 122.529 2.153 . . . . 11.63 112.528 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.487 ' HA ' HD12 ' A' ' 41' ' ' LEU . 23.4 mp0 -69.24 -19.19 63.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.025 -0.534 . . . . 13.31 111.839 -179.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.481 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 36.7 mt-10 -73.45 -24.05 60.18 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.945 0.402 . . . . 17.34 110.426 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.604 ' HB2' HG21 ' A' ' 25' ' ' VAL . 1.8 mm? -93.45 -28.49 16.08 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.071 -0.513 . . . . 13.25 110.286 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 91.8 mt -61.17 131.8 51.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.925 -0.579 . . . . 12.99 110.772 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 75.99 11.72 84.54 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.928 -0.653 . . . . 13.39 112.681 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.783 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 7.9 mmpt? -129.47 159.61 35.74 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.696 0.284 . . . . 16.87 110.388 179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.4 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 13.3 m120 -94.02 138.23 32.35 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.157 -0.474 . . . . 12.5 110.197 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.41 HG13 ' HE1' ' A' ' 78' ' ' PHE . 17.2 tt -60.25 -25.7 34.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.013 -0.539 . . . . 11.72 111.3 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.8 p -68.38 -20.84 25.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 116.342 -0.39 . . . . 12.89 111.413 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.4 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 39.1 mt-10 -76.99 -23.62 52.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.048 0.451 . . . . 16.53 110.4 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -106.11 15.09 26.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.885 -0.598 . . . . 15.34 109.984 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 17.1 t -106.62 147.98 28.86 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.461 -0.79 . . . . 11.97 110.843 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.415 ' CD2' ' HD2' ' A' ' 51' ' ' PRO . 7.4 t-160 -57.76 127.76 79.19 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 115.58 -0.736 . . . . 14.67 109.36 178.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.415 ' HD2' ' CD2' ' A' ' 50' ' ' HIS . 80.7 Cg_exo -45.18 -52.17 6.82 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.475 2.783 . . . . 15.15 113.976 -179.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -67.67 -8.91 38.77 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.315 0.487 . . . . 16.47 112.315 -179.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.542 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 27.8 m-20 -114.84 -1.48 13.18 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.793 0.33 . . . . 13.16 110.893 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.402 ' OE1' ' HA ' ' A' ' 51' ' ' PRO . 83.5 mt-30 -62.39 -46.2 89.69 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.24 -0.436 . . . . 15.83 111.099 -179.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -63.01 -38.19 90.19 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.64 -0.504 . . . . 13.94 109.64 178.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.3 tp -61.7 -43.35 99.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.626 -0.716 . . . . 12.11 109.925 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.438 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.3 OUTLIER -63.99 -52.52 59.2 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.781 -0.645 . . . . 9.71 110.706 179.487 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 33.6 ttt180 -58.22 -46.3 86.13 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.319 -0.4 . . . . 11.06 111.385 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.473 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 34.7 t70 -61.5 -45.58 93.6 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.71 -0.223 . . . . 9.71 110.914 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 45.2 m -63.61 -37.53 87.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.972 0.415 . . . . 9.52 110.557 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.5 ' O ' HG23 ' A' ' 65' ' ' VAL . 2.8 m-30 -63.3 -37.33 86.84 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.106 -0.497 . . . . 11.4 109.993 178.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 -73.32 -33.06 64.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.182 -0.463 . . . . 10.04 109.92 178.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.473 ' HG3' ' O ' ' A' ' 59' ' ' ASP . 52.9 mt-30 -63.53 -45.33 91.09 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.878 -0.601 . . . . 10.6 110.991 179.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.499 HG12 ' O ' ' A' ' 61' ' ' PHE . 6.3 p -65.29 -25.23 36.71 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 CA-C-N 116.538 -0.301 . . . . 10.62 111.472 -179.231 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 61' ' ' PHE . 79.5 t -70.82 -32.77 50.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 109.405 -0.591 . . . . 12.41 109.405 178.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 34.8 mtpt -82.56 -18.31 41.81 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.43 -0.805 . . . . 16.25 110.245 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 92.1 mt -83.03 -54.16 5.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.012 -0.54 . . . . 12.66 109.967 179.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 57.6 mttt 61.4 94.98 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.914 0.759 . . . . 14.83 112.814 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 107.17 -25.48 21.87 Favored Glycine 0 N--CA 1.454 -0.109 0 C-N-CA 120.423 -0.894 . . . . 9.8 113.753 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -90.33 131.54 36.07 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 110.156 -0.313 . . . . 9.59 110.156 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.46 ' HB ' ' HZ ' ' B' ' 24' ' ' PHE . 3.7 p -77.54 113.07 16.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-O 121.269 0.557 . . . . 8.1 110.491 -179.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 33.3 tp -102.19 100.16 10.34 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.038 -0.528 . . . . 7.8 110.602 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.429 ' HA ' ' HA ' ' A' ' 91' ' ' SER . 0.0 OUTLIER -81.66 115.01 20.72 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.607 -0.724 . . . . 7.59 110.363 179.478 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.6 p -109.52 122.95 64.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 120.915 0.388 . . . . 7.84 110.172 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 27.7 ttt -97.17 111.96 23.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.261 -0.427 . . . . 9.35 111.065 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.542 ' HB2' ' HB3' ' A' ' 53' ' ' ASP . 48.3 p90 -140.49 -173.47 3.69 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.195 -0.669 . . . . 9.66 109.195 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.455 ' HB3' ' HB3' ' A' ' 85' ' ' TRP . 12.9 mtm180 -105.59 122.17 45.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.105 0.479 . . . . 13.1 110.649 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.41 ' HE1' HG13 ' A' ' 45' ' ' ILE . 23.1 t80 -104.27 152.61 22.01 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.671 -0.695 . . . . 9.28 110.203 -179.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.616 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 46.9 ttp180 -92.83 128.43 38.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.871 0.367 . . . . 10.87 111.018 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.65 ' HA ' ' HB ' ' A' ' 33' ' ' VAL . 77.5 p -90.76 -176.63 4.75 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 109.698 -0.482 . . . . 10.77 109.698 179.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.443 ' HA ' ' HD2' ' A' ' 81' ' ' LYS . 40.3 tptt -71.41 -12.2 61.29 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.376 0.608 . . . . 12.66 109.614 178.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -90.84 2.98 55.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.404 -0.816 . . . . 14.42 109.342 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 65.24 23.72 12.22 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-N 115.029 -0.987 . . . . 12.69 111.104 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.494 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 3.6 pt-20 -99.2 160.15 14.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 10.85 109.888 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.616 ' CZ3' ' HB2' ' A' ' 79' ' ' ARG . 64.8 m95 -106.47 110.66 22.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.521 -0.309 . . . . 11.2 110.638 -179.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.432 ' H ' ' HG ' ' A' ' 86' ' ' LEU . 0.8 OUTLIER -113.72 154.94 26.47 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.264 -0.426 . . . . 11.12 110.072 179.643 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.437 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 97.9 m95 -75.04 120.5 20.65 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.247 0.546 . . . . 10.28 111.416 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 47.8 tpp -119.44 130.71 55.4 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.221 -0.9 . . . . 9.32 110.416 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.515 ' HB3' ' HB ' ' A' ' 111' ' ' THR . 3.1 ttp180 -101.87 73.97 1.44 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.042 -0.725 . . . . 10.66 109.042 178.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.644 HG23 ' HB3' ' A' ' 108' ' ' CYS . 52.3 m -64.34 114.43 4.27 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.694 -0.685 . . . . 9.37 111.651 -179.242 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.595 ' O ' ' HA ' ' A' ' 108' ' ' CYS . 0.7 OUTLIER -89.75 94.45 9.84 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.385 -0.825 . . . . 8.27 109.873 179.948 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.431 ' HA ' ' SG ' ' A' ' 108' ' ' CYS . 5.3 m -77.5 117.45 18.96 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.982 0.42 . . . . 8.65 111.532 -179.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -122.91 117.55 25.82 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.837 -0.619 . . . . 11.56 109.77 179.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.56 127.75 33.6 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.227 -0.442 . . . . 10.16 111.664 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -104.03 118.53 36.89 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.586 -0.524 . . . . 12.25 109.586 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -108.54 149.17 29.22 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.215 0.531 . . . . 14.24 111.928 -178.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.47 ' HA ' ' HD3' ' A' ' 98' ' ' PRO . 12.0 t-20 -97.19 132.89 24.75 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 115.36 -0.836 . . . . 13.83 109.612 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' A' ' 97' ' ' ASN . 27.5 Cg_exo -63.27 -6.31 9.74 Favored 'Trans proline' 0 N--CA 1.476 0.486 0 C-N-CA 123.358 2.705 . . . . 15.34 114.467 -178.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -62.84 -61.51 2.36 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.643 0.258 . . . . 16.89 110.436 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -145.31 27.95 1.23 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.736 0.303 . . . . 14.89 111.0 179.096 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 27.7 t70 63.52 41.9 7.0 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.529 -0.759 . . . . 14.77 111.782 179.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -91.36 142.47 27.65 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.351 -0.386 . . . . 12.95 110.067 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 48.9 mt -88.75 102.3 12.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.047 -0.353 . . . . 11.11 110.047 179.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.482 ' H ' ' HG2' ' A' ' 104' ' ' GLU . 2.5 pt-20 -71.26 -41.37 70.14 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.71 0.291 . . . . 11.65 110.974 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.446 ' HB2' ' O ' ' A' ' 16' ' ' HIS . 20.6 p90 -161.6 178.96 8.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.777 0.322 . . . . 10.3 110.642 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 44.4 mt -122.24 123.24 68.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.092 -0.504 . . . . 10.29 110.634 -179.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.626 HG21 HH22 ' B' ' 15' ' ' ARG . 85.8 mt -91.12 112.7 25.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.11 -0.7 . . . . 8.99 109.11 179.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.644 ' HB3' HG23 ' A' ' 90' ' ' THR . 96.8 m -113.76 116.59 29.63 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.372 0.508 . . . . 9.83 112.372 -178.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.559 HG23 HD13 ' A' ' 13' ' ' ILE . 0.2 OUTLIER -82.92 110.55 18.0 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.69 -0.856 . . . . 10.84 108.69 177.865 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.632 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 3.9 m-20 -85.56 98.33 10.58 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.882 0.372 . . . . 11.26 111.448 -178.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.515 ' HB ' ' HB3' ' A' ' 89' ' ' ARG . 1.3 m -93.75 110.55 22.18 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.756 -0.657 . . . . 11.22 111.165 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . 0.812 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 3.8 t-20 -75.64 111.93 11.48 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.588 -0.523 . . . . 12.78 109.588 178.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . 0.486 HG12 ' HG3' ' A' ' 114' ' ' LYS . 39.5 t -91.4 -53.41 8.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-N 116.072 -0.513 . . . . 14.64 110.488 -179.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.486 ' HG3' HG12 ' A' ' 113' ' ' VAL . 54.7 mtpt . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.406 -0.806 . . . . 16.02 110.056 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 18.8 m . . . . . 0 N--CA 1.478 0.96 0 CA-C-O 120.716 0.294 . . . . 7.49 110.295 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' GLN . . . . . 0.749 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 33.5 mm-40 -75.81 146.18 79.24 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.386 -0.37 . . . . 7.12 110.94 -179.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' B' ' 8' ' ' GLN . 5.5 Cg_exo -80.54 -167.41 0.5 Allowed 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 123.276 2.651 . . . . 6.18 112.812 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . 0.738 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.1 OUTLIER -99.32 47.04 0.96 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.218 0.532 . . . . 5.81 110.936 -179.707 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.503 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -151.76 151.53 31.51 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.543 -0.91 . . . . 5.85 108.543 179.593 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' PHE . . . . . 0.631 ' HB2' ' HB3' ' B' ' 26' ' ' ASP . 18.8 p90 -161.32 158.72 27.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.412 0.625 . . . . 6.08 112.019 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.539 HG13 HG21 ' A' ' 109' ' ' THR . 24.7 mm -85.51 118.81 32.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 115.091 -0.959 . . . . 5.57 110.542 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.443 ' HB3' ' HE1' ' B' ' 22' ' ' PHE . 0.8 OUTLIER -112.79 89.2 3.01 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.199 -0.455 . . . . 5.3 110.761 179.9 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . 0.626 HH22 HG21 ' A' ' 107' ' ' ILE . 8.1 mtp180 -83.4 110.83 18.48 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.387 -0.597 . . . . 8.97 109.387 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . 0.522 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 33.6 p80 -136.68 162.53 32.9 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.548 -0.296 . . . . 8.31 110.616 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -78.14 174.97 10.59 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.208 -0.293 . . . . 10.83 110.208 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 27.0 pt -59.71 -24.11 28.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 N-CA-C 113.109 0.781 . . . . 8.89 113.109 -178.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -77.54 -22.01 51.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.935 0.398 . . . . 11.92 110.981 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 112.72 -7.82 25.94 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.558 -0.83 . . . . 8.57 112.368 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . . . . . . . . . 33.9 mm -69.71 116.71 11.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 110.186 -0.301 . . . . 10.87 110.186 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . 0.522 ' HA ' ' HB3' ' B' ' 16' ' ' HIS . 94.7 m-85 -66.13 121.4 15.07 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.091 -0.504 . . . . 8.23 111.106 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -92.19 -40.25 11.11 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.779 -0.646 . . . . 7.91 110.363 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . 0.46 ' HZ ' ' HB ' ' A' ' 71' ' ' VAL . 47.6 t80 -155.44 120.87 4.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.101 -0.499 . . . . 7.89 110.29 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . . . . . . . . . 10.6 m -115.86 154.68 17.33 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.032 0.444 . . . . 6.1 111.218 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . 0.631 ' HB3' ' HB2' ' B' ' 12' ' ' PHE . 9.2 t70 -74.47 165.03 25.88 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.428 -0.806 . . . . 7.15 110.233 179.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 4.2 m170 -82.27 -8.7 59.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.838 0.352 . . . . 8.97 110.981 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . 0.749 ' HG2' ' HB3' ' B' ' 8' ' ' GLN . 72.1 mtm180 -69.1 -14.62 63.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.006 -0.543 . . . . 9.76 111.974 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 28.4 p -57.28 -31.66 65.84 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 111.725 0.269 . . . . 11.56 111.725 -178.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . 0.423 HG13 HE22 ' B' ' 36' ' ' GLN . 25.1 t -63.05 -38.74 82.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.205 -0.452 . . . . 13.64 111.108 -179.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.04 -17.57 30.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.771 0.32 . . . . 12.9 110.968 179.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 41.5 m -80.39 -58.82 2.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.167 -0.47 . . . . 12.13 111.849 -179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' VAL . . . . . 0.505 ' HB ' ' HA ' ' B' ' 80' ' ' SER . 3.5 m -127.68 -2.07 3.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 112.24 0.459 . . . . 13.87 112.24 -178.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.29 -19.94 28.85 Favored Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 120.705 -0.759 . . . . 13.79 112.564 179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' TYR . . . . . 0.442 ' HB2' HG23 ' B' ' 33' ' ' VAL . 4.2 m-85 -62.95 129.63 41.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.708 0.29 . . . . 15.38 110.668 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . 0.588 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 40.4 mm-40 -73.74 151.89 89.1 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 109.54 -0.541 . . . . 13.78 109.54 179.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.504 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 61.3 Cg_exo -51.58 -38.86 65.85 Favored 'Trans proline' 0 CA--C 1.53 0.32 0 C-N-CA 122.757 2.304 . . . . 14.71 112.778 -179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 24.3 mp0 -71.44 -13.38 61.81 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.883 -0.599 . . . . 17.54 111.821 -179.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.588 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 30.4 mt-10 -85.14 -19.8 31.24 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.8 0.333 . . . . 14.24 110.293 179.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -92.24 -45.1 8.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.016 -0.538 . . . . 14.03 110.377 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 51.5 mt -58.56 126.39 27.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.009 -0.541 . . . . 13.62 111.211 -179.249 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 89.53 -5.16 83.99 Favored Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 115.778 -0.646 . . . . 11.62 112.261 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.804 ' HE2' ' HA ' ' B' ' 43' ' ' LYS . 6.7 mmpt? -112.05 160.05 17.87 Favored 'General case' 0 C--N 1.322 -0.625 0 O-C-N 122.758 -0.26 . . . . 13.82 110.433 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' ASN . . . . . 0.826 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 17.7 m120 -92.61 138.12 31.78 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.601 -0.518 . . . . 10.16 109.601 179.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . 0.438 ' HB ' ' CZ ' ' B' ' 22' ' ' PHE . 14.4 tt -62.9 -28.07 44.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-O 121.034 0.445 . . . . 9.62 111.055 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' VAL . . . . . . . . . . . . . 5.1 p -71.5 -18.64 20.19 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 CA-C-N 116.224 -0.444 . . . . 11.5 111.72 -179.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . 0.826 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 42.9 mt-10 -69.57 -37.41 76.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.902 0.382 . . . . 11.89 110.968 -179.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 25.3 m-85 -98.74 18.19 17.53 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.023 0.439 . . . . 13.6 110.405 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 41.1 t -101.65 145.67 28.77 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.888 -0.596 . . . . 10.81 110.616 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' HIS . . . . . 0.482 ' CD2' ' HD2' ' B' ' 51' ' ' PRO . 5.5 t-160 -55.64 128.61 69.32 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 115.537 -0.756 . . . . 11.49 109.92 178.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' PRO . . . . . 0.482 ' HD2' ' CD2' ' B' ' 50' ' ' HIS . 95.7 Cg_exo -44.57 -51.72 6.81 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 123.516 2.811 . . . . 11.35 113.628 -179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -70.07 -4.19 19.98 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.184 0.439 . . . . 9.28 112.184 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . 0.435 ' HB3' ' HB2' ' B' ' 76' ' ' PHE . 53.5 m-20 -120.54 -0.32 10.32 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.866 0.365 . . . . 7.52 110.502 -179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -62.72 -43.51 98.62 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.97 -0.559 . . . . 6.57 111.209 -179.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 48.6 tp60 -69.41 -39.31 77.97 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.425 -0.352 . . . . 6.58 110.189 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 58.0 tp -59.64 -39.81 85.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 4.6 110.483 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.42 HD22 ' CZ ' ' B' ' 61' ' ' PHE . 0.7 OUTLIER -62.85 -50.42 71.0 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.003 -0.544 . . . . 6.4 110.33 179.267 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 52.8 ttt180 -61.43 -43.45 98.85 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.103 -0.499 . . . . 8.18 110.923 -179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . 0.444 ' O ' ' HG3' ' B' ' 63' ' ' GLN . 25.3 t70 -60.0 -46.52 89.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.812 0.339 . . . . 6.07 110.296 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 36.6 m -61.42 -34.2 74.99 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.959 -0.564 . . . . 5.59 110.426 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' PHE . . . . . 0.49 ' O ' HG12 ' B' ' 64' ' ' VAL . 10.7 m-85 -65.35 -39.8 92.82 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.295 0.569 . . . . 7.73 109.535 178.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -67.4 -35.55 79.52 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.802 -0.636 . . . . 6.89 110.171 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' B' ' 59' ' ' ASP . 34.8 mt-30 -69.28 -44.51 71.69 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.941 -0.572 . . . . 9.4 111.514 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.56 ' HA ' HD12 ' B' ' 67' ' ' LEU . 9.9 p -63.49 -29.22 46.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-O 120.719 0.295 . . . . 7.57 110.692 -179.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . 0.686 ' HA ' HG21 ' B' ' 94' ' ' THR . 61.3 t -70.44 -35.48 62.24 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.1 0 N-CA-C 109.638 -0.505 . . . . 7.43 109.638 178.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -67.66 -39.97 84.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.843 -0.617 . . . . 10.21 110.039 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.56 HD12 ' HA ' ' B' ' 64' ' ' VAL . 25.6 mt -66.17 -49.0 68.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.564 -0.744 . . . . 7.2 110.082 179.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 14.6 tttt 60.75 98.41 0.03 OUTLIER 'General case' 0 C--O 1.234 0.244 0 CA-C-N 115.474 -0.785 . . . . 7.58 112.228 179.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.83 20.36 34.16 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.751 -0.738 . . . . 5.57 112.427 179.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -124.89 154.06 41.67 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.569 -0.53 . . . . 5.43 109.569 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' VAL . . . . . 0.589 ' CG2' ' HB3' ' B' ' 91' ' ' SER . 2.7 p -103.96 117.36 49.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-O 121.283 0.564 . . . . 5.65 110.582 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 13.0 tp -108.86 111.05 22.56 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.773 -0.649 . . . . 4.51 110.09 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . 0.575 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 12.7 m -87.06 112.18 21.63 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.233 -0.44 . . . . 6.35 111.117 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 3.2 p -108.82 131.19 60.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.039 -0.528 . . . . 4.34 110.061 179.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 25.4 ttt -100.85 115.11 29.6 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.077 0.465 . . . . 5.42 110.912 -179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.483 ' HE1' ' HB ' ' B' ' 90' ' ' THR . 50.7 p90 -143.99 178.17 8.04 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.649 -0.705 . . . . 3.54 109.456 179.662 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' ARG . . . . . 0.56 ' HB3' ' HB3' ' B' ' 85' ' ' TRP . 12.1 mtm180 -101.09 122.23 43.21 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.998 0.428 . . . . 6.8 110.112 179.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.432 ' HD1' ' HE2' ' B' ' 76' ' ' PHE . 25.5 t80 -105.78 145.81 30.68 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.604 -0.726 . . . . 5.79 110.119 -179.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' ARG . . . . . 0.547 ' HB2' ' CZ3' ' B' ' 85' ' ' TRP . 30.4 ttt180 -87.22 122.35 30.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.141 -0.481 . . . . 11.08 110.782 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . 0.505 ' HA ' ' HB ' ' B' ' 33' ' ' VAL . 76.5 p -86.37 -176.81 6.03 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.085 -0.507 . . . . 7.47 109.746 179.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . 0.417 ' HA ' ' HD2' ' B' ' 81' ' ' LYS . 35.5 tptt -70.63 -13.06 61.94 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.496 0.665 . . . . 12.24 109.581 178.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 82.1 m-20 -88.61 0.03 56.79 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.595 -0.73 . . . . 9.25 109.626 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 69.76 20.19 6.93 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.393 -0.821 . . . . 8.3 110.832 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . 0.435 ' O ' ' HA ' ' B' ' 79' ' ' ARG . 2.8 pt-20 -98.94 151.4 20.93 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.348 -0.387 . . . . 6.78 110.118 179.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . 0.56 ' HB3' ' HB3' ' B' ' 77' ' ' ARG . 44.2 m95 -100.76 103.2 14.43 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.246 -0.434 . . . . 7.89 110.587 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.43 ' H ' ' HG ' ' B' ' 86' ' ' LEU . 0.8 OUTLIER -103.46 151.84 22.35 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.221 -0.445 . . . . 6.97 110.346 179.642 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 87' ' ' TRP . . . . . 0.684 ' HB2' ' HB2' ' B' ' 114' ' ' LYS . 89.7 m95 -76.37 114.4 15.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.246 0.546 . . . . 8.55 110.759 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 21.4 tpp -115.21 129.89 56.77 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.216 -0.902 . . . . 4.46 110.792 -178.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 5.0 ttp180 -99.49 85.07 3.08 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 108.566 -0.901 . . . . 6.87 108.566 178.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 90' ' ' THR . . . . . 0.492 HG23 ' HB3' ' B' ' 108' ' ' CYS . 22.7 m -78.82 113.19 16.7 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.759 -0.655 . . . . 6.18 111.86 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 91' ' ' SER . . . . . 0.629 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 20.3 m -93.66 87.7 5.58 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.63 -0.714 . . . . 6.3 109.815 178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . 0.57 ' HA ' ' HA ' ' B' ' 108' ' ' CYS . 14.4 m -72.74 128.75 36.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.903 -0.59 . . . . 6.65 111.419 -178.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -122.71 126.41 47.49 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.106 -0.497 . . . . 6.45 110.021 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . 0.686 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.1 OUTLIER -83.3 107.7 16.01 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.709 0.29 . . . . 9.17 110.501 179.406 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . 0.46 ' HE1' ' HE2' ' A' ' 24' ' ' PHE . 0.3 OUTLIER -86.27 129.73 34.75 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.381 -0.372 . . . . 8.33 110.558 -179.466 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 7.0 mt-30 -108.48 131.51 54.74 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.011 -0.54 . . . . 10.53 111.028 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 97' ' ' ASN . . . . . 0.43 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 55.9 t30 -71.49 127.9 90.59 Favored Pre-proline 0 C--N 1.32 -0.706 0 N-CA-C 108.866 -0.79 . . . . 8.43 108.866 178.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . 0.43 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 57.4 Cg_endo -70.37 45.39 0.52 Allowed 'Trans proline' 0 CA--C 1.534 0.501 0 C-N-CA 123.175 2.583 . . . . 9.16 113.137 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -126.53 -54.22 1.45 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.44 -0.345 . . . . 11.34 110.702 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 48.5 m -137.11 21.43 3.01 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.745 -0.207 . . . . 7.75 111.201 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 25.4 t70 64.8 20.2 12.06 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 121.525 0.679 . . . . 9.08 110.492 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 4.3 pm0 -79.95 142.51 35.01 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.083 -0.508 . . . . 7.71 110.477 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 80.8 mt -76.53 110.86 12.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.751 -0.463 . . . . 8.04 109.751 179.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.435 ' H ' ' HG2' ' B' ' 104' ' ' GLU . 5.7 pt-20 -73.04 -45.09 59.59 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.555 -0.293 . . . . 8.81 110.468 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 4.7 p90 -168.56 165.61 12.29 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.939 0.4 . . . . 7.4 110.758 179.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 32.7 mt -101.36 113.52 37.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.883 -0.599 . . . . 6.78 109.667 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.529 HG12 ' HG2' ' B' ' 15' ' ' ARG . 64.2 mt -88.72 100.33 10.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.917 -0.583 . . . . 6.31 110.005 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' CYS . . . . . 0.57 ' HA ' ' HA ' ' B' ' 92' ' ' SER . 54.0 m -88.38 106.87 18.53 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.106 0.479 . . . . 5.31 111.204 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . 0.629 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 0.4 OUTLIER -81.39 87.03 6.19 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.273 -0.64 . . . . 5.48 109.273 178.576 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -69.61 141.47 53.69 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.692 -0.686 . . . . 6.9 110.6 -178.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 2.6 m -149.47 113.53 5.16 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.107 -0.331 . . . . 8.61 110.107 179.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 112' ' ' ASN . . . . . 0.738 ' HB3' ' HB ' ' B' ' 10' ' ' THR . 17.7 t-20 -70.08 133.38 47.11 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.195 0.521 . . . . 11.84 110.987 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . 0.476 HG12 ' HG3' ' B' ' 114' ' ' LYS . 66.2 t -113.6 -51.25 5.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.557 -0.747 . . . . 11.77 109.359 179.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . 0.684 ' HB2' ' HB2' ' B' ' 87' ' ' TRP . 61.0 mtpt . . . . . 0 C--O 1.246 0.871 0 CA-C-O 118.369 -0.825 . . . . 12.68 109.609 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 56.7 m . . . . . 0 N--CA 1.475 0.784 0 CA-C-O 120.882 0.373 . . . . 15.6 110.432 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -86.13 117.62 69.02 Favored Pre-proline 0 C--N 1.323 -0.553 0 N-CA-C 109.836 -0.431 . . . . 15.08 109.836 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.8 154.49 58.83 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.598 2.198 . . . . 13.43 112.164 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.846 ' HB ' ' HB3' ' A' ' 112' ' ' ASN . 0.7 OUTLIER -79.92 56.09 2.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.493 0.663 . . . . 11.09 110.516 179.593 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.513 ' HA ' ' O ' ' A' ' 110' ' ' ASN . 15.6 tt0 -157.12 117.78 3.58 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.058 -0.974 . . . . 10.59 108.939 -178.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.868 ' HB2' ' HB3' ' A' ' 26' ' ' ASP . 35.7 p90 -140.77 162.14 36.12 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.365 0.602 . . . . 8.93 112.191 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.453 HG23 HG23 ' A' ' 107' ' ' ILE . 42.8 mm -93.99 124.93 46.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.467 -0.788 . . . . 8.66 110.802 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.586 ' HB3' ' HE1' ' A' ' 22' ' ' PHE . 2.4 m -115.14 105.77 13.31 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.27 -0.423 . . . . 6.11 110.934 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -89.97 112.58 24.03 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.278 -0.638 . . . . 9.09 109.278 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 34.2 p80 -139.22 159.9 41.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.474 0.178 . . . . 9.79 110.991 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -77.98 174.9 10.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.443 -0.344 . . . . 12.69 110.226 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 14.9 pt -57.32 -27.92 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 N-CA-C 113.236 0.828 . . . . 13.58 113.236 -178.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -80.44 -17.91 50.33 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.107 0.48 . . . . 13.85 111.453 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 110.11 0.1 29.94 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.506 -0.854 . . . . 9.38 112.793 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ILE . . . . . 0.482 ' HA ' ' O ' ' A' ' 43' ' ' LYS . 30.9 mm -72.73 118.42 17.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 109.719 -0.474 . . . . 10.74 109.719 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.586 ' HE1' ' HB3' ' A' ' 14' ' ' SER . 90.1 m-85 -72.07 124.91 25.96 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.059 0.457 . . . . 9.73 111.924 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -97.39 -29.2 13.64 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.365 -0.834 . . . . 7.74 110.078 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . . . . . . . . . 18.2 t80 -158.27 125.54 5.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.714 -0.676 . . . . 6.92 110.01 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.482 HG21 ' HB2' ' A' ' 40' ' ' LEU . 9.5 t -118.96 134.82 61.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.407 -0.36 . . . . 6.02 111.006 -179.376 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.868 ' HB3' ' HB2' ' A' ' 12' ' ' PHE . 9.7 t70 -66.26 139.41 58.08 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.011 -0.54 . . . . 7.31 109.771 179.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -62.77 -14.23 42.51 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.332 0.493 . . . . 11.67 112.332 -179.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.429 ' HB2' ' HB3' ' A' ' 12' ' ' PHE . 79.7 mtm180 -69.04 -10.97 60.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.675 0.274 . . . . 11.91 111.282 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 27.8 p -60.6 -31.98 71.12 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.765 0.317 . . . . 12.99 110.515 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.59 HG13 HE22 ' A' ' 36' ' ' GLN . 42.5 t -62.04 -35.3 67.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.77 -0.65 . . . . 16.15 111.296 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -91.25 -8.1 49.35 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.825 0.345 . . . . 15.07 111.69 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.694 ' HA ' HG22 ' A' ' 10' ' ' THR . 24.7 m -97.13 -55.23 2.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.856 0.36 . . . . 14.9 111.322 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.419 HG12 HD21 ' A' ' 86' ' ' LEU . 2.9 m -117.18 -13.61 10.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.405 -0.361 . . . . 13.84 111.741 -179.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.427 ' HA2' ' O ' ' A' ' 30' ' ' VAL . . . 92.11 -15.15 62.67 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.603 -0.808 . . . . 13.85 112.524 179.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -75.01 139.01 42.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.564 0.221 . . . . 18.28 110.662 179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.59 HE22 HG13 ' A' ' 30' ' ' VAL . 33.9 mm-40 -80.59 149.8 68.8 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 109.394 -0.595 . . . . 15.48 109.394 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.592 ' O ' ' HG ' ' A' ' 41' ' ' LEU . 51.2 Cg_exo -54.8 -37.41 92.27 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.411 2.074 . . . . 11.63 112.388 -179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.494 ' HA ' HD12 ' A' ' 41' ' ' LEU . 15.5 mp0 -69.77 -19.07 63.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.125 -0.489 . . . . 13.31 111.347 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.536 ' HG3' ' HB2' ' A' ' 36' ' ' GLN . 47.1 mt-10 -82.11 -14.33 55.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.971 0.415 . . . . 17.34 110.37 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.482 ' HB2' HG21 ' A' ' 25' ' ' VAL . 3.2 mm? -101.07 -27.31 13.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.866 -0.606 . . . . 13.25 110.301 179.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' ' 37' ' ' PRO . 95.1 mt -60.64 125.54 24.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.947 -0.569 . . . . 12.99 110.673 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 81.54 2.71 90.62 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.872 -0.68 . . . . 13.39 112.366 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.725 ' HE2' ' HA ' ' A' ' 43' ' ' LYS . 9.1 mmpt? -111.69 160.49 17.22 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.776 0.322 . . . . 16.87 110.647 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.68 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 16.0 m120 -96.48 135.58 38.16 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.041 -0.527 . . . . 12.5 109.698 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.555 HG13 ' HE1' ' A' ' 78' ' ' PHE . 10.6 tt -59.53 -26.09 33.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.18 0.514 . . . . 11.72 110.947 179.176 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.521 HG12 ' HB3' ' A' ' 44' ' ' ASN . 9.9 p -69.93 -22.18 24.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 CA-C-N 115.716 -0.675 . . . . 12.89 111.424 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.68 ' HG3' ' HB2' ' A' ' 44' ' ' ASN . 43.5 mt-10 -70.05 -36.06 74.72 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-O 121.303 0.573 . . . . 16.53 110.731 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -101.69 34.74 2.53 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.769 -0.65 . . . . 15.34 110.443 -179.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 36.0 t -120.9 150.25 41.36 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.623 -0.717 . . . . 11.97 110.296 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' HIS . . . . . 0.413 ' HB3' ' HB2' ' A' ' 53' ' ' ASP . 7.9 t-160 -58.64 126.23 79.16 Favored Pre-proline 0 C--N 1.329 -0.312 0 N-CA-C 109.147 -0.686 . . . . 14.67 109.147 178.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -44.51 -48.97 9.61 Favored 'Trans proline' 0 C--N 1.345 0.369 0 C-N-CA 123.348 2.699 . . . . 15.15 114.17 -178.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -73.75 -4.5 34.98 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.36 0.504 . . . . 16.47 112.36 -179.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.429 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 9.3 m-20 -115.37 -2.13 12.7 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.947 0.403 . . . . 13.16 111.133 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -63.11 -41.0 99.25 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.92 -0.582 . . . . 15.83 111.156 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.1 tp60 -64.61 -43.33 94.09 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.732 -0.469 . . . . 13.94 109.732 179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.8 tp -59.73 -39.34 84.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.756 -0.656 . . . . 12.11 110.139 178.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.469 ' HA ' HD23 ' A' ' 57' ' ' LEU . 0.4 OUTLIER -62.91 -51.31 67.43 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.842 -0.617 . . . . 9.71 110.402 179.421 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.425 ' O ' ' HG2' ' A' ' 62' ' ' GLN . 62.0 ttt180 -63.25 -43.13 98.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.074 -0.512 . . . . 11.06 110.756 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.461 ' O ' ' HG3' ' A' ' 63' ' ' GLN . 33.6 t70 -59.02 -47.98 83.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.273 -0.421 . . . . 9.71 110.475 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.6 m -62.63 -34.96 78.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.967 -0.56 . . . . 9.52 110.524 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.606 ' O ' HG12 ' A' ' 64' ' ' VAL . 3.5 m-30 -63.96 -42.18 97.35 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.872 -0.418 . . . . 11.4 109.872 178.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 58' ' ' ARG . 18.0 mm100 -67.98 -32.73 73.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.305 -0.407 . . . . 10.04 110.12 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.461 ' HG3' ' O ' ' A' ' 59' ' ' ASP . 39.2 mt-30 -70.73 -38.52 73.58 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.095 -0.502 . . . . 10.6 111.035 179.647 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.606 HG12 ' O ' ' A' ' 61' ' ' PHE . 2.7 p -67.42 -25.84 34.38 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 CA-C-O 120.857 0.36 . . . . 10.62 110.519 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.536 HG23 ' O ' ' A' ' 61' ' ' PHE . 89.7 t -74.94 -21.81 16.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 N-CA-C 108.89 -0.782 . . . . 12.41 108.89 178.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.7 mtpt -86.07 -32.62 21.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.393 -0.821 . . . . 16.25 109.489 178.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.833 ' HB3' ' HB3' ' A' ' 70' ' ' GLN . 82.0 mt -69.06 -54.87 12.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.586 -0.733 . . . . 12.66 110.538 179.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 95.1 mttt 59.67 97.59 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.977 0.798 . . . . 14.83 112.325 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.28 -12.38 68.11 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.647 -0.787 . . . . 9.8 112.235 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.833 ' HB3' ' HB3' ' A' ' 67' ' ' LEU . 6.7 tp-100 -99.2 137.22 38.02 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.322 -0.621 . . . . 9.59 109.322 179.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.473 ' HB ' ' HZ ' ' B' ' 24' ' ' PHE . 3.9 p -88.88 121.93 39.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 121.3 0.572 . . . . 8.1 110.792 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 41.0 tp -109.45 115.49 30.05 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.699 -0.682 . . . . 7.8 109.734 179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.3 m -92.46 104.17 16.52 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.113 -0.494 . . . . 7.59 111.031 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.445 HG13 ' HB ' ' A' ' 90' ' ' THR . 2.4 p -96.98 125.29 50.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.017 -0.538 . . . . 7.84 109.803 179.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 18.5 ttt -100.98 115.43 30.46 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.995 0.426 . . . . 9.35 111.025 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.429 ' HB2' ' HB3' ' A' ' 53' ' ' ASP . 40.6 p90 -146.28 -172.69 4.0 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.478 -0.783 . . . . 9.66 109.116 179.367 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.66 ' HB3' ' HB3' ' A' ' 85' ' ' TRP . 55.9 mtm180 -108.97 118.27 36.36 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.164 0.507 . . . . 13.1 110.833 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.555 ' HE1' HG13 ' A' ' 45' ' ' ILE . 18.2 t80 -96.71 149.63 21.59 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.4 -0.818 . . . . 9.28 110.407 -179.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.614 ' HB2' ' CZ3' ' A' ' 85' ' ' TRP . 17.1 ttt180 -87.0 121.56 29.64 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.163 -0.471 . . . . 10.87 111.133 -179.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.443 ' OG ' ' HG2' ' A' ' 84' ' ' GLU . 60.4 p -88.25 178.63 6.55 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.156 -0.474 . . . . 10.77 110.201 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -70.62 -13.53 62.12 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.272 0.558 . . . . 12.66 109.934 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -89.97 2.56 54.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.532 -0.758 . . . . 14.42 109.624 179.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 67.34 31.98 6.16 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.415 -0.811 . . . . 12.69 111.046 -179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.53 ' O ' ' HA ' ' A' ' 79' ' ' ARG . 4.1 pt-20 -108.09 171.47 7.39 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.326 -0.62 . . . . 10.85 109.326 179.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' TRP . . . . . 0.66 ' HB3' ' HB3' ' A' ' 77' ' ' ARG . 23.7 m95 -120.41 98.57 6.11 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 110.079 -0.341 . . . . 11.2 110.079 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' A' ' 77' ' ' ARG . 1.1 pp -96.8 151.93 19.17 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.334 -0.393 . . . . 11.12 110.886 -179.435 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.533 ' HB2' ' HB2' ' A' ' 114' ' ' LYS . 95.5 m95 -73.93 116.54 14.67 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.257 0.551 . . . . 10.28 110.66 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 36.2 tpp -116.54 131.76 56.86 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.397 -0.82 . . . . 9.32 110.79 -179.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.412 ' HB3' ' HB ' ' A' ' 111' ' ' THR . 5.2 ttp180 -100.87 70.14 1.37 Allowed 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.326 -0.99 . . . . 10.66 108.326 178.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.445 ' HB ' HG13 ' A' ' 74' ' ' VAL . 41.7 m -60.78 107.34 0.68 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.58 -0.736 . . . . 9.37 112.27 -178.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' SER . . . . . 0.493 ' HB2' ' HB ' ' A' ' 109' ' ' THR . 0.7 OUTLIER -86.52 88.92 7.74 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.11 -0.95 . . . . 8.27 109.719 179.407 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 18.7 m -77.92 126.43 30.83 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.135 -0.484 . . . . 8.65 111.369 -179.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 23.3 t80 -131.12 117.23 18.79 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.864 -0.607 . . . . 11.56 109.887 179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.93 118.73 16.23 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.298 -0.41 . . . . 10.16 110.729 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -91.86 119.8 31.97 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.018 0.437 . . . . 12.25 110.619 -179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.493 ' HG2' HG12 ' A' ' 103' ' ' ILE . 34.0 mt-30 -124.15 167.51 14.16 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.75 -0.659 . . . . 14.24 110.003 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.441 ' HB2' ' HD2' ' A' ' 99' ' ' TYR . 64.1 m-80 -115.89 172.87 3.36 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 109.381 -0.6 . . . . 13.83 109.381 179.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.418 ' CD ' ' HB3' ' A' ' 97' ' ' ASN . 6.8 Cg_exo -75.69 28.87 0.38 Allowed 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.522 2.148 . . . . 15.34 112.308 178.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . 0.441 ' HD2' ' HB2' ' A' ' 97' ' ' ASN . 62.4 m-85 -92.87 -160.6 0.76 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.325 -0.398 . . . . 16.89 110.818 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 1.2 m -83.26 65.19 8.15 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.613 0.598 . . . . 14.89 112.613 -178.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 41.0 t0 51.01 76.18 0.17 Allowed 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.646 -0.707 . . . . 14.77 112.45 178.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.31 165.57 20.29 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.844 -0.617 . . . . 12.95 109.884 179.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.493 HG12 ' HG2' ' A' ' 96' ' ' GLN . 80.1 mt -136.86 120.83 23.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 110.218 -0.289 . . . . 11.11 110.218 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.406 ' H ' ' HG2' ' A' ' 104' ' ' GLU . 5.1 pt-20 -81.16 -44.55 17.71 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.614 -0.434 . . . . 11.65 110.469 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 7.2 p90 -165.46 178.18 6.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.481 -0.327 . . . . 10.3 110.52 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 40.8 mt -115.57 122.95 70.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.078 -0.51 . . . . 10.29 110.224 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.682 HG21 HH22 ' B' ' 15' ' ' ARG . 61.8 mt -93.21 114.84 30.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.13 -0.486 . . . . 8.99 109.863 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 79.5 m -108.77 119.47 39.62 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.119 0.485 . . . . 9.83 111.423 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.493 ' HB ' ' HB2' ' A' ' 91' ' ' SER . 2.6 m -88.16 101.01 13.4 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.643 -0.873 . . . . 10.84 108.643 178.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . 0.513 ' O ' ' HA ' ' A' ' 11' ' ' GLU . 42.6 m-20 -79.23 104.32 9.77 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.232 -0.44 . . . . 11.26 111.547 -178.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' THR . . . . . 0.412 ' HB ' ' HB3' ' A' ' 89' ' ' ARG . 5.6 m -104.18 118.83 37.59 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.623 -0.717 . . . . 11.22 110.515 179.541 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . 0.846 ' HB3' ' HB ' ' A' ' 10' ' ' THR . 3.5 t-20 -80.82 117.9 21.87 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.015 0.435 . . . . 12.78 110.299 179.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 18.9 t -97.77 -54.62 6.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.864 -0.607 . . . . 14.64 109.776 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.533 ' HB2' ' HB2' ' A' ' 87' ' ' TRP . 48.9 mtpt . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.224 -0.893 . . . . 16.02 109.52 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 71.5 m . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 110.108 -0.33 . . . . 7.49 110.108 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' GLN . . . . . 0.938 ' HB3' ' HG2' ' B' ' 28' ' ' ARG . 93.0 mm-40 -112.85 150.42 42.79 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-N 116.529 -0.305 . . . . 7.12 110.828 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.2 174.32 12.67 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 123.015 2.476 . . . . 6.18 113.131 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . 0.508 ' HB ' ' HB3' ' B' ' 112' ' ' ASN . 0.0 OUTLIER -83.56 58.51 4.61 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 116.001 -0.545 . . . . 5.81 111.536 -179.86 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.589 ' O ' ' HD2' ' B' ' 28' ' ' ARG . 7.7 pt-20 -166.42 136.42 3.24 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.173 -0.677 . . . . 5.85 109.173 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' PHE . . . . . 0.41 ' HB3' ' HB2' ' B' ' 28' ' ' ARG . 39.6 p90 -146.12 156.61 43.56 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.331 0.586 . . . . 6.08 112.005 -179.047 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.503 HG22 ' HG3' ' B' ' 15' ' ' ARG . 28.0 mm -86.08 119.13 33.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.359 -0.837 . . . . 5.57 110.264 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.797 ' HB3' ' HE2' ' B' ' 22' ' ' PHE . 1.2 m -107.13 92.12 3.95 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.963 -0.562 . . . . 5.3 110.507 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' ARG . . . . . 0.682 HH22 HG21 ' A' ' 107' ' ' ILE . 8.5 mtp180 -85.3 102.06 13.06 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.308 -0.627 . . . . 8.97 109.308 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' HIS . . . . . 0.419 ' HB3' ' HA ' ' B' ' 22' ' ' PHE . 29.9 p80 -131.43 164.07 26.54 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.236 -0.438 . . . . 8.31 110.872 -179.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -78.2 179.18 7.05 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.318 -0.401 . . . . 10.83 110.621 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 27.3 pt -56.88 -33.32 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 N-CA-C 113.252 0.834 . . . . 8.89 113.252 -178.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -76.13 -21.94 56.04 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.088 0.471 . . . . 11.92 111.382 -179.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 114.05 -4.19 23.97 Favored Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 120.665 -0.779 . . . . 8.57 112.327 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' ILE . . . . . 0.43 ' HA ' ' O ' ' B' ' 43' ' ' LYS . 38.7 mm -67.15 114.26 3.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 N-CA-C 109.939 -0.393 . . . . 10.87 109.939 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' PHE . . . . . 0.797 ' HE2' ' HB3' ' B' ' 14' ' ' SER . 97.3 m-85 -68.48 126.32 29.27 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.168 -0.469 . . . . 8.23 111.242 -179.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 3.9 m -100.01 -37.88 8.81 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.61 -0.723 . . . . 7.91 110.171 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . 0.486 ' HB3' ' HD3' ' B' ' 15' ' ' ARG . 30.1 t80 -147.77 123.41 10.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.675 -0.693 . . . . 7.89 109.496 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' VAL . . . . . 0.536 HG21 ' HB2' ' B' ' 40' ' ' LEU . 14.5 t -120.46 138.87 49.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 120.884 0.374 . . . . 6.1 111.074 -179.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . 0.403 ' CG ' ' HE ' ' B' ' 28' ' ' ARG . 10.7 t70 -71.15 153.55 42.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.852 -0.613 . . . . 7.15 109.971 179.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 34.9 m170 -70.16 -10.82 60.0 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.806 0.299 . . . . 8.97 111.806 -178.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . 0.938 ' HG2' ' HB3' ' B' ' 8' ' ' GLN . 72.7 mtm180 -68.08 -11.45 59.07 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 111.995 0.368 . . . . 9.76 111.995 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' CYS . . . . . . . . . . . . . 20.2 p -58.32 -38.76 77.77 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 111.861 0.319 . . . . 11.56 111.861 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' VAL . . . . . . . . . . . . . 4.1 t -66.39 -31.96 55.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.338 -0.392 . . . . 13.64 111.072 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.63 -10.82 56.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.904 0.383 . . . . 12.9 111.458 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . 0.455 ' HA ' HG22 ' B' ' 10' ' ' THR . 14.8 m -99.74 -59.83 1.64 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.068 -0.515 . . . . 12.13 111.978 -179.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' VAL . . . . . 0.726 HG12 HD21 ' B' ' 86' ' ' LEU . 3.3 m -116.57 -5.48 11.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 N-CA-C 111.824 0.305 . . . . 13.87 111.824 -179.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 84.22 0.94 89.61 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.651 -0.785 . . . . 13.79 112.285 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' TYR . . . . . 0.45 ' HB2' HG23 ' B' ' 33' ' ' VAL . 2.4 m-85 -80.1 137.0 36.66 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.644 0.259 . . . . 15.38 111.054 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . 0.57 ' HB2' ' HG3' ' B' ' 39' ' ' GLU . 75.8 mm-40 -79.4 150.01 73.03 Favored Pre-proline 0 C--N 1.322 -0.63 0 N-CA-C 108.667 -0.864 . . . . 13.78 108.667 178.256 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . 0.528 ' O ' ' HG ' ' B' ' 41' ' ' LEU . 51.6 Cg_exo -53.18 -38.5 81.26 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.613 2.208 . . . . 14.71 112.303 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 22.2 mp0 -67.79 -22.2 65.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.965 -0.561 . . . . 17.54 111.408 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' GLU . . . . . 0.57 ' HG3' ' HB2' ' B' ' 36' ' ' GLN . 36.4 mt-10 -73.82 -23.12 59.62 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.655 0.264 . . . . 14.24 110.951 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.536 ' HB2' HG21 ' B' ' 25' ' ' VAL . 1.7 mm? -93.17 -34.92 13.42 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.895 0.379 . . . . 14.03 110.625 179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' B' ' 37' ' ' PRO . 81.7 mt -58.31 119.07 6.26 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 13.62 111.259 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . 88.33 5.01 76.55 Favored Glycine 0 N--CA 1.454 -0.163 0 C-N-CA 121.002 -0.618 . . . . 11.62 112.636 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.457 ' HA ' ' NZ ' ' B' ' 43' ' ' LYS . 0.5 OUTLIER -119.04 159.53 23.71 Favored 'General case' 0 C--N 1.321 -0.664 0 O-C-N 122.586 -0.361 . . . . 13.82 110.353 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' ASN . . . . . 0.672 ' HB2' ' HG3' ' B' ' 47' ' ' GLU . 12.5 m120 -95.46 140.15 30.73 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 109.35 -0.611 . . . . 10.16 109.35 178.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 20.8 tt -61.28 -24.63 33.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.305 0.574 . . . . 9.62 110.542 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' VAL . . . . . 0.41 HG12 ' HB3' ' B' ' 44' ' ' ASN . 9.0 p -71.84 -22.68 21.64 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 115.774 -0.648 . . . . 11.5 111.183 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' GLU . . . . . 0.672 ' HG3' ' HB2' ' B' ' 44' ' ' ASN . 40.5 mt-10 -67.07 -34.6 78.0 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 121.164 0.507 . . . . 11.89 110.481 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 45.2 m-85 -104.08 24.67 11.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.729 -0.669 . . . . 13.6 110.433 -179.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' CYS . . . . . . . . . . . . . 49.0 t -109.19 148.78 30.38 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.832 -0.622 . . . . 10.81 110.41 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' HIS . . . . . . . . . . . . . 8.1 t-160 -64.9 126.72 91.69 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.713 -0.676 . . . . 11.49 109.236 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -43.24 -48.8 7.81 Favored 'Trans proline' 0 CA--C 1.535 0.547 0 C-N-CA 123.534 2.823 . . . . 11.35 113.779 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -70.53 -7.91 47.34 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.135 0.42 . . . . 9.28 112.135 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' ASP . . . . . 0.637 ' HB3' ' HB2' ' B' ' 76' ' ' PHE . 16.5 m-20 -117.57 -1.17 11.71 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.951 0.405 . . . . 7.52 110.706 -179.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -65.14 -49.22 70.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.969 -0.559 . . . . 6.57 111.659 -178.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . 48.3 tp60 -64.96 -34.86 79.43 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.504 -0.554 . . . . 6.58 109.504 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 29.3 tp -58.09 -42.92 86.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.961 -0.563 . . . . 4.6 109.777 178.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' LEU . . . . . 0.454 HD23 ' HA ' ' B' ' 57' ' ' LEU . 0.9 OUTLIER -69.16 -48.95 60.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.94 -0.573 . . . . 6.4 110.265 179.007 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' B' ' 58' ' ' ARG . 28.5 ttt180 -57.45 -46.32 83.75 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.875 -0.602 . . . . 8.18 111.244 -179.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . 0.4 ' O ' ' HG3' ' B' ' 63' ' ' GLN . 12.7 t70 -61.0 -41.21 96.07 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.227 -0.442 . . . . 6.07 110.744 179.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 44.6 m -64.15 -35.54 81.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.147 -0.479 . . . . 5.59 110.486 179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' PHE . . . . . 0.508 ' O ' HG12 ' B' ' 64' ' ' VAL . 9.7 m-85 -64.18 -40.85 96.97 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 109.475 -0.565 . . . . 7.73 109.475 178.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -63.15 -38.83 92.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.96 -0.564 . . . . 6.89 109.969 178.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' GLN . . . . . 0.513 ' O ' ' HG ' ' B' ' 67' ' ' LEU . 68.6 mt-30 -67.14 -47.62 70.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.688 -0.687 . . . . 9.4 111.132 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' VAL . . . . . 0.508 HG12 ' O ' ' B' ' 61' ' ' PHE . 4.1 p -62.24 -30.99 50.11 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-N 116.387 -0.37 . . . . 7.57 111.864 -178.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . 0.478 HG23 ' O ' ' B' ' 61' ' ' PHE . 70.9 t -68.75 -37.65 77.78 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 109.516 -0.55 . . . . 7.43 109.516 178.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 44.5 mtpt -71.57 -32.72 68.39 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.786 -0.643 . . . . 10.21 110.165 179.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' B' ' 63' ' ' GLN . 94.0 mt -67.33 -54.13 23.4 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.854 -0.612 . . . . 7.2 110.365 179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' LYS . . . . . . . . . . . . . 23.5 mttt 63.26 113.37 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.439 -0.8 . . . . 7.58 112.008 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 77.26 19.81 76.23 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.798 -0.715 . . . . 5.57 112.17 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -126.01 153.5 44.3 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.937 -0.394 . . . . 5.43 109.937 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' VAL . . . . . 0.519 ' CG2' ' HB3' ' B' ' 91' ' ' SER . 3.3 p -110.96 116.37 52.33 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-O 121.299 0.571 . . . . 5.65 110.518 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' LEU . . . . . . . . . . . . . 18.7 tp -107.95 116.56 32.18 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.701 -0.681 . . . . 4.51 110.306 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' SER . . . . . 0.547 ' HA ' ' HA ' ' B' ' 91' ' ' SER . 7.6 m -90.36 115.7 27.75 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.175 -0.466 . . . . 6.35 110.995 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.8 p -113.83 126.96 71.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 116.096 -0.502 . . . . 4.34 110.107 179.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' MET . . . . . . . . . . . . . 24.7 ttt -94.83 113.79 25.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.167 0.508 . . . . 5.42 110.563 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.637 ' HB2' ' HB3' ' B' ' 53' ' ' ASP . 48.0 p90 -137.9 -174.58 3.82 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.63 -0.714 . . . . 3.54 109.397 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' ARG . . . . . . . . . . . . . 9.3 mtm180 -108.3 115.19 29.66 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.99 0.424 . . . . 6.8 110.11 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.552 ' HD2' HG11 ' B' ' 33' ' ' VAL . 28.0 t80 -100.52 148.46 24.77 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.656 -0.702 . . . . 5.79 110.282 -179.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' ARG . . . . . 0.535 ' HA ' ' O ' ' B' ' 84' ' ' GLU . 20.2 ttp180 -85.77 133.47 33.99 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.142 -0.481 . . . . 11.08 110.725 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . 0.476 ' HA ' ' HB ' ' B' ' 33' ' ' VAL . 96.6 p -93.14 179.48 5.41 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.522 -0.547 . . . . 7.47 109.522 178.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' LYS . . . . . . . . . . . . . 47.3 tptt -67.89 -14.76 63.22 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.607 0.718 . . . . 12.24 109.53 178.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' ASN . . . . . . . . . . . . . 40.0 m-20 -89.02 2.52 53.89 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.151 -0.931 . . . . 9.25 109.685 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 66.49 25.08 10.22 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-N 115.305 -0.862 . . . . 8.3 111.522 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . 0.535 ' O ' ' HA ' ' B' ' 79' ' ' ARG . 1.9 pt-20 -104.29 167.15 9.94 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.228 -0.656 . . . . 6.78 109.228 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' TRP . . . . . 0.518 ' CZ3' ' HB2' ' B' ' 79' ' ' ARG . 49.3 m95 -109.04 118.82 37.79 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.049 0.452 . . . . 7.89 110.69 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.726 HD21 HG12 ' B' ' 33' ' ' VAL . 2.1 pp -116.02 150.38 37.33 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.004 -0.544 . . . . 6.97 109.986 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 87' ' ' TRP . . . . . . . . . . . . . 97.5 m95 -72.73 122.19 21.09 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.871 -0.418 . . . . 8.55 109.871 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 88' ' ' MET . . . . . . . . . . . . . 15.0 tpp -128.35 126.6 41.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.135 -0.484 . . . . 4.46 110.96 -179.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 30.3 ttp180 -100.19 87.58 3.49 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.292 -1.003 . . . . 6.87 108.292 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 90' ' ' THR . . . . . 0.457 HG23 ' HB3' ' B' ' 108' ' ' CYS . 28.0 m -80.66 112.87 18.42 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.672 -0.694 . . . . 6.18 112.309 -178.305 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 91' ' ' SER . . . . . 0.67 ' HB2' ' HB ' ' B' ' 109' ' ' THR . 44.5 m -88.76 90.67 8.51 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.584 -0.734 . . . . 6.3 109.179 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 92' ' ' SER . . . . . 0.541 ' HA ' ' HA ' ' B' ' 108' ' ' CYS . 15.6 m -78.77 122.37 25.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.235 -0.438 . . . . 6.65 111.502 -178.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -118.17 121.37 40.33 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.284 -0.417 . . . . 6.45 110.562 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 94' ' ' THR . . . . . 0.437 HG21 ' HA ' ' B' ' 65' ' ' VAL . 0.6 OUTLIER -86.19 100.72 12.43 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.426 -0.352 . . . . 9.17 110.189 179.051 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 95' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -76.71 126.28 30.7 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.988 0.423 . . . . 8.33 111.084 -179.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 96' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -94.84 116.33 28.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.867 -0.606 . . . . 10.53 109.731 179.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 97' ' ' ASN . . . . . 0.402 ' OD1' ' HD2' ' B' ' 98' ' ' PRO . 51.5 t30 -65.46 126.75 92.11 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 109.544 -0.539 . . . . 8.43 109.544 179.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 98' ' ' PRO . . . . . 0.402 ' HD2' ' OD1' ' B' ' 97' ' ' ASN . 58.2 Cg_endo -71.29 42.72 0.46 Allowed 'Trans proline' 0 CA--C 1.531 0.339 0 C-N-CA 123.076 2.518 . . . . 9.16 113.693 -178.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -118.56 -61.2 1.69 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.407 -0.59 . . . . 11.34 109.407 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -135.14 22.47 3.49 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.638 -0.71 . . . . 7.75 109.868 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 4.3 t70 63.42 24.59 14.21 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.549 -0.75 . . . . 9.08 110.727 -179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -84.93 143.03 29.25 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.995 0.426 . . . . 7.71 110.462 -179.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' ILE . . . . . . . . . . . . . 67.1 mt -79.72 109.43 14.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.295 -0.412 . . . . 8.04 109.896 179.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -71.6 -41.93 68.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.422 -0.353 . . . . 8.81 110.647 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -169.89 168.63 8.65 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.296 -0.411 . . . . 7.4 109.911 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 22.1 mt -103.21 118.89 50.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.106 -0.497 . . . . 6.78 110.036 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 46.3 mt -88.62 93.19 4.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.74 -0.664 . . . . 6.31 109.912 179.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' CYS . . . . . 0.541 ' HA ' ' HA ' ' B' ' 92' ' ' SER . 67.1 m -87.75 116.79 26.14 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.183 -0.462 . . . . 5.31 111.295 -179.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . 0.67 ' HB ' ' HB2' ' B' ' 91' ' ' SER . 1.2 m -88.69 83.38 6.73 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.149 -0.686 . . . . 5.48 109.149 178.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' ASN . . . . . 0.525 ' O ' ' HA ' ' B' ' 11' ' ' GLU . 6.1 m-20 -67.24 103.08 1.16 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.707 -0.679 . . . . 6.9 111.14 -178.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' THR . . . . . . . . . . . . . 1.1 m -110.85 114.39 27.7 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.415 -0.357 . . . . 8.61 110.332 179.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 112' ' ' ASN . . . . . 0.579 HD22 HD13 ' B' ' 86' ' ' LEU . 4.6 t-20 -68.65 135.32 51.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.02 0.438 . . . . 11.84 110.772 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 113' ' ' VAL . . . . . . . . . . . . . 9.4 t -104.29 -59.06 3.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.868 -0.606 . . . . 11.77 109.627 179.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 24.3 mtpt . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.207 -0.902 . . . . 12.68 109.945 -179.858 . . . . . . . . 0 0 . 1 stop_ save_